EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

3-hydroxybenzaldehyde
3-formylphenol

Supplier Sponsors

CAS Number: 100-83-4Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:202-892-9
FDA UNII: 8Z2819J40E
Nikkaji Web:J43.313F
Beilstein Number:0507099
MDL:MFCD00003368
XlogP3:1.40 (est)
Molecular Weight:122.12322000
Formula:C7 H6 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:information only not used for fragrances or flavors
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 108.00 °C. @ 760.00 mm Hg
Boiling Point: 240.00 °C. @ 760.00 mm Hg
Boiling Point: 240.00 to 241.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.014000 mmHg @ 25.00 °C. (est)
Flash Point: 209.00 °F. TCC ( 98.60 °C. ) (est)
logP (o/w): 1.290
Soluble in:
 alcohol
 water, 7190 mg/L @ 25 °C (exp)
Insoluble in:
 water
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
3-hydroxybenzaldehyde 98%
EMD Millipore
For experimental / research use only.
3-Hydroxybenzaldehyde
sds
ExtraSynthese
For experimental / research use only.
3-Hydroxybenzaldehyde
Hunan Astar Bio-Chemical Technology
For experimental / research use only.
3-Hydroxybenzaldehyde
Odor: characteristic
Use: Mainly used as pharmaceuticals, dyes, fungicides, photographic emulsifier and other fine chemicals intermediates
Penta International
3-HYDROXYBENZALDEHYDE
Santa Cruz Biotechnology
For experimental / research use only.
3-Hydroxybenzaldehyde
Sigma-Aldrich: Aldrich
For experimental / research use only.
3-Hydroxybenzaldehyde 97%
sds
TCI AMERICA
For experimental / research use only.
3-Hydroxybenzaldehyde >98.0%(GC)(T)
sds
 
Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
information only not used for fragrances or flavors
Recommendation for 3-hydroxybenzaldehyde usage levels up to:
 not for fragrance use.
 
Recommendation for 3-hydroxybenzaldehyde flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):100-83-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :101
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
3-hydroxybenzaldehyde
Chemidplus:0000100834
RTECS:CU6450000 for cas# 100-83-4
 
References:
 3-hydroxybenzaldehyde
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):101
Pubchem (sid):134972870
Pherobase:View
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEBI:View
CHEMBL:View
UM BBD:Search
KEGG (GenomeNet):C03067
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2912.49.2600
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 benzaldehyde, 3-hydroxy-
meta-formyl phenol
3-formylphenol
m-formylphenol
meta-formylphenol
m-hydroxybenzaldehyde
meta-hydroxybenzaldehyde
 

Articles:

PubMed:Nontargeted GC-MS approach for volatile profile of toasting in cherry, chestnut, false acacia, and ash wood.
PubMed:Purification and characterization of NAD+ -dependent salicylaldehyde dehydrogenase from carbaryl-degrading Pseudomonas sp. strain C6.
PubMed:Quantum chemical studies, vibrational analysis, molecular structure, first order hyper polarizability, NBO and HOMO-LUMO analysis of 3-hydroxybenzaldehyde and its cation.
PubMed:The first synthesis of [11C]J147, a new potential PET agent for imaging of Alzheimer's disease.
PubMed:New 1,3,4-bisthiadiazolines: synthesis, characterization and antimicrobial evaluations.
PubMed:Thermochemical data and additivity group values for ten species of o-xylene low-temperature oxidation mechanism.
PubMed:Growth and characterization of organic material 3-hydroxybenzaldehyde single crystal by modified vertical Bridgman technique.
PubMed:Interference of H-bonding and substituent effects in nitro- and hydroxy-substituted salicylaldehydes.
PubMed:Synthesis of novel biologically active heterocyclic compounds from 2-oxo-2H-benzopyran-6-yl-imidazolidine.
PubMed:A mild conversion from 3-vinyl- to 3-formyl-chlorophyll derivatives.
PubMed:Electrochemical, catalytic and antimicrobial activity of N-functionalized tetraazamacrocyclic binuclear nickel(II) complexes.
PubMed:Hydrogen bond, dimerization and vibrational modes in 2-chloro-3-hydroxybenzaldehyde and 3-chloro-4-hydroxybenzaldehyde from vibrational and ab initio studies.
PubMed:Generalized solvent scales as a tool for investigating solvent dependence of spectroscopic and kinetic parameters. Application to fluorescent BODIPY dyes.
PubMed:Antioxidative flavonoids from Cleistocalyx operculatus buds.
PubMed:Mutagenic, antimutagenic and antioxidant activities of a new polyphenolic and a flavonoid substances isolated from Anagallis monelli.
PubMed:Asymmetric total synthesis of (-)-quinocarcin.
PubMed:Combinatorial synthesis and characterization of new asymmetric porphyrins as potential photosensitizers in photodynamic therapy.
PubMed:Cytotoxic effects of 2-arylbenzofuran phytoestrogens on human cancer cells: modulation by adrenal and gonadal steroids.
PubMed:Antioxidant and anticancer activity of 3'-formyl-4', 6'-dihydroxy-2'-methoxy-5'-methylchalcone and (2S)-8-formyl-5-hydroxy-7-methoxy-6-methylflavanone.
PubMed:A new copper(I)-tetrahydrosalen-catalyzed asymmetric Henry reaction and its extension to the synthesis of (S)-norphenylephrine.
PubMed:Synthesis and characterization of a novel functionalized azanonaborane cluster for boron neutron capture therapy.
PubMed:Subphthalocyanines: tuneable molecular scaffolds for intramolecular electron and energy transfer processes.
PubMed:A benzil and isoflavone derivatives from Derris scandens Benth.
PubMed:IR spectral and structural changes caused by the conversion of 3-hydroxybenzaldehyde into the oxyanion.
PubMed:Effects of aldehyde dehydrogenase-2 genetic polymorphisms on metabolism of structurally different aldehydes in human liver.
PubMed:Tetranuclear mixed-metal M(II)2Cu(II)2 complexes derived from a phenol-based macrocyclic ligand having two N(amine)2O2 and two N(imine)2O2 metal-binding sites.
PubMed:GC/ITMS measurement of carbonyls and multifunctional carbonyls in PM2.5 particles emitted from motor vehicles.
PubMed:3-Hydroxybenzaldehyde.
PubMed:Methoxy-substituted 3-formyl-2-phenylindoles inhibit tubulin polymerization.
PubMed:XH-14 analogues as adenosine antagonists.
PubMed:Anaerobic Degradation of m-Cresol by a Sulfate-Reducing Bacterium.
PubMed:Synthesis and biological activity of 4-amino-5-chloro-2-ethoxy-3-hydroxybenzamides, metabolites of a new gastroprokinetic agent, mosapride.
PubMed:Bidirectional transformation of aromatic aldehydes by Desulfovibrio desulfuricans under nitrate-dissimilating conditions.
PubMed:Spectrophotometric determination of mixtures of 2-, 3-, and 4-hydroxybenzaldehydes by flow injection analysis and uv/vis photodiode-array detection.
PubMed:Spectrophotometric resolution of ternary mixtures of salicylaldehyde, 3-hydroxybenzaldehyde and 4-hydroxybenzaldehyde by the derivative ratio spectrum-zero crossing method.
PubMed:TAN-931, a novel nonsteroidal aromatase inhibitor produced by Penicillium funiculosum No. 8974. II. Structure elucidation, chemical modification and biological activity.
PubMed:Nematocidal principles in "oakmoss absolute" and nematocidal activity of 2,4-dihydroxybenzoates.
PubMed:Kinetic spectrophotometric determination of nanogram amounts of cyanide.
PubMed:Substrate preference of a cytosolic aldehyde dehydrogenase inducible in rat liver by treatment with 3-methylcholanthrene.
PubMed:Liquid chromatographic determination of inhibition of monoamine oxidase activity in platelet rich plasma of depressed patients treated with phenelzine.
PubMed:Liquid chromatographic determination of urinary metanephrines after pre-column oxidation to vanillin.
PubMed:[Experimental observations on the iodination of phenols in the preparation of intermediates of pharmaceutical interest].
PubMed:Conidiogenesis and secondary metabolism in Penicillium urticae.
PubMed:Patulin biosynthesis: the metabolism of m-hydroxybenzyl alcohol and m-hydroxybenzaldehyde by particulate preparations from Penicillium patulum.
 
Notes:
None found
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