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4-methyl-3-heptanol
3-heptanol, 4-methyl- (VAN) (8CI)(9CI)

Supplier Sponsors

Name:4-methylheptan-3-ol
CAS Number: 14979-39-6Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:239-058-9
FDA UNII: L4RU749510
Nikkaji Web:J49.363E
Beilstein Number:1733008
MDL:MFCD00004568
XlogP3-AA:2.70 (est)
Molecular Weight:130.23066000
Formula:C8 H18 O
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
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Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.82700 @ 25.00 °C.
Boiling Point: 170.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.900000 mmHg @ 25.00 °C. (est)
Flash Point: 130.00 °F. TCC ( 54.44 °C. )
logP (o/w): 2.630 (est)
Soluble in:
 water, 1420 mg/L @ 25 °C (exp)
 water, 1594 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
4-Methyl-3-heptanol, mixture of isomers 95%
Santa Cruz Biotechnology
For experimental / research use only.
4-Methyl-3-heptanol, mixture of isomers
Sigma-Aldrich: Aldrich
For experimental / research use only.
4-Methyl-3-heptanol, mixture of isomers ≥99%
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:
intravenous-mouse LD50 180 mg/kg
U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03236

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
natural substances and extractives
Recommendation for 4-methyl-3-heptanol usage levels up to:
 not for fragrance use.
 
Recommendation for 4-methyl-3-heptanol flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :26989
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
4-methylheptan-3-ol
Chemidplus:0014979396
RTECS:MJ4600000 for cas# 14979-39-6
 
References:
 4-methylheptan-3-ol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):26989
Pubchem (sid):134990136
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2905.16.0050
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
2-amyl ethyl carbinol
 ethyl 2-pentyl carbinol
 heptan-3-ol, 4-methyl-
3-heptanol, 4-methyl-
3-heptanol, 4-methyl- (VAN) (8CI)(9CI)
3-heptanol, 4-methyl- (VAN8CI9CI)
4-methyl heptan-3-ol
4-methylheptan-3-ol
 

Articles:

PubMed:Broadband dynamics in neat 4-methyl-3-heptanol and in mixtures with 2-ethyl-1-hexanol.
PubMed:How do high pressures change the Debye process of 4-methyl-3-heptanol?
PubMed:Debye relaxation and 250 K anomaly in glass forming monohydroxy alcohols.
PubMed:Antimicrobial activities of components of the glandular secretions of leaf cutting ants of the genus Atta.
PubMed:Synthesis and biological activity of the four stereoisomers of 4-methyl-3-heptanol: main component of the aggregation pheromone of Scolytus amygdali.
PubMed:Variation with caste of the mandibular gland secretion in the leaf-cutting antAtta sexdens rubropilosa.
PubMed:Components of moribund American elm trees as attractants to elm bark beetles,Hylurgopinus rufipes andScolytus multistriatus.
PubMed:Effect of multilure and its components on parasites ofScolytus multistriatus (Coleoptera: Scolytidae).
PubMed:Effects of multilure components on twig-crotch feeding by European elm bark beetles.
PubMed:Structure-activity correlations among analogs of 4-methyl-3-heptanol, a pheromone component of the european elm bark beetle (Scolytus multistriatus).
PubMed:Field response of the dutch elm disease vectors,Scolytus multistriatus (Marsham) andS. scolytus (F.) (Coleoptera: Scolytidae) to 4-methyl-3-heptanol baits containing α-, β-,δ-, or δ-multistriatin.
PubMed:Response ofScolytus multistriatus (Coleoptera: Scolytidae) to α- and δ-multistriatin in Switzerland.
PubMed:Electroantennogram responses ofScolytus multistriatus (Coleoptera: Scolytidae) to its pheromone components and to associated compounds.
PubMed:Responses of the olfactory receptors ofScolytus scolytus (F.) (Coleoptera: Scolytidae) to the stereoisomers of 4-methyl-3-heptanol.
 
Notes:
None found
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