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

cyclobutanol
hydroxycyclobutane

Supplier Sponsors

Name:cyclobutanol
CAS Number: 2919-23-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:220-858-1
FDA UNII: Search
Nikkaji Web:J80.593I
Beilstein Number:2035937
MDL:MFCD00001318
XlogP3-AA:0.50 (est)
Molecular Weight:72.10696000
Formula:C4 H8 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
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: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.92600 to 0.93100 @ 20.00 °C.
Pounds per Gallon - (est).: 7.714 to 7.756
Refractive Index:1.43400 to 1.43700 @ 20.00 °C.
Boiling Point: 123.00 to 125.00 °C. @ 760.00 mm Hg
Boiling Point: 123.00 °C. @ 733.00 mm Hg
Vapor Pressure:6.101000 mmHg @ 25.00 °C. (est)
Flash Point: 70.00 °F. TCC ( 21.00 °C. )
logP (o/w): 0.228 (est)
Soluble in:
 water, 1.201e+005 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.
Cyclobutanol
Santa Cruz Biotechnology
For experimental / research use only.
Cyclobutanol
Sigma-Aldrich: Aldrich
For experimental / research use only.
Cyclobutanol ≥99%
TCI AMERICA
For experimental / research use only.
Cyclobutanol >98.0%(GC)
 
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:
natural substances and extractives
Recommendation for cyclobutanol usage levels up to:
 not for fragrance use.
 
Recommendation for cyclobutanol 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):2919-23-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :76218
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 1987
WGK Germany:3
cyclobutanol
Chemidplus:0002919235
 
References:
 cyclobutanol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):76218
Pubchem (sid):135034237
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2906.19.5000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
 cyclobutyl hydroxide
 hydroxycyclobutane
 

Articles:

PubMed:Enantioselective insertion of a carbenoid carbon into a C-C bond to expand cyclobutanols to cyclopentanols.
PubMed:Asymmetric chlorination/ring expansion for the synthesis of α-quaternary cycloalkanones.
PubMed:Platinum(II) complexes with N-monoalkyl 1R,2R-diaminocyclohexane derivatives as carrier ligands and 3-hydroxycyclobutane-1,1-dicarboxylate as a leaving group: potent cytotoxicity and DNA binding ability.
PubMed:pH-sensitive DNA cleaving agents: in situ activation by ring contraction of benzo-fused cyclobutanols.
PubMed:A product of a templated solid-state photodimerization acts as a template: single-crystal reactivity in a single polymorph of a cocrystal.
PubMed:Cyclohexyne cycloinsertion in the divergent synthesis of guanacastepenes.
PubMed:The effects of H-bonding and sterics on the photoreactivity of a trimethyl butyrophenone derivative.
PubMed:[Development of domino reactions based on skeletal rearrangement].
PubMed:A 1H NMR and theoretical investigation of the conformations of some monosubstituted cyclobutanes.
PubMed:Mechanism of alcohol oxidation by dipicolinate vanadium(V): unexpected role of pyridine.
PubMed:SmI2-mediated radical cyclizations directed by a C-Si bond.
PubMed:Stereocontrolled synthesis of spiro[n.2]alkenes by ring contraction of fused-cyclobutanols.
PubMed:Fe-catalyzed highly selective ring expansion of alkynylcyclopropyl alkanols to cyclobutanols.
PubMed:Cascade synthesis of (E)-2-alkylidenecyclobutanols.
PubMed:Aerobic oxidation of pinacol by vanadium(V) dipicolinate complexes: evidence for reduction to vanadium(III).
PubMed:Stereoselective, dual-mode ruthenium-catalyzed ring expansion of alkynylcyclopropanols.
PubMed:Non-natural amino acids as modulating agents of the conformational space of model glycopeptides.
PubMed:Conformational stability of cyclobutanol from temperature dependent infrared spectra of xenon solutions, r0 structural parameters, ab initio calculations and vibrational assignment.
PubMed:Pestalotiopsin A. Side chain installation and exhaustive probing of olefin metathesis as a possible tool for elaborating the cyclononene ring.
PubMed:Pestalotiopsin a. Enantioselective construction of potential building blocks derived from antipodal cyclobutanol intermediates.
PubMed:Cleavage of activated cyclic amines: Unprecedented approach toward 2-substituted cyclobutanones.
PubMed:Photolysis of heptanal.
PubMed:In pursuit of pestalotiopsin a via zirconocene-mediated ring contraction.
PubMed:Versatile diastereoselectivity in formal [3,3]-sigmatropic shifts of substituted 1-alkenyl-3-alkylidenecyclobutanols and their silyl ethers.
PubMed:The low-temperature and high-pressure crystal structures of cyclobutanol (C4H7OH).
PubMed:Core size effects on the reactivity of organic substrates as monolayers on gold nanoparticles.
PubMed:Synthesis of cyclobutane serine analogues.
PubMed:Reactivity of aqueous Fe(IV) in hydride and hydrogen atom transfer reactions.
PubMed:Investigations of alpha-siloxy-epoxide ring expansions forming 1-azaspirocyclic ketones.
PubMed:Switching between novel samarium(II)-mediated cyclizations by a simple change in alcohol cosolvent.
PubMed:Reactivity of 2-acylaminoacrylates with ketene diethyl acetal; [2 + 2] cycloadditions vs. tandem condensations.
PubMed:Improved synthesis of anti-[18F]FACBC: improved preparation of labeling precursor and automated radiosynthesis.
PubMed:Synthesis of 2-alkylidenecyclopentanones via palladium-catalyzed carbopalladation/ring expansion of 1-(1-alkynyl)cyclobutanols.
PubMed:Solid-phase synthesis of novel isoxazolocyclobutanones and isoxazolinocyclobutenones.
PubMed:Stereoselective synthesis of 2-aminocyclobutanols via photocyclization of alpha-amido alkylaryl ketones: mechanistic implications for the Norrish/Yang reaction.
PubMed:Synthesis of 2-alkylidenecyclopentanones via palladium-catalyzed cross-coupling of 1-(1-Alkynyl)cyclobutanols and aryl or vinylic halides
PubMed:Fast interconversion of C4H7+ cations in the gas phase and in a gaseous microsolvated environment
PubMed:[New methods of constructing fluorinated organic compounds and their application].
PubMed:Synthesis and antiviral activity of 3'-fluorocarbocyclic oxetanocin A.
PubMed:An approach to sequence-specific antibody proteases. The use of haptens mimicking both a transition state and a distorted ground state.
PubMed:Synthesis and antiviral activity of carbocyclic oxetanocin analogues (C-OXT-A, C-OXT-G) and related compounds. II.
PubMed:cis-2-amino-1-hydroxycyclobutane-1-acetic acid, a herbicidal antimetabolite produced by Streptomyces rochei A13018.
PubMed:Methane monooxygenase catalyzed oxygenation of 1,1-dimethylcyclopropane. Evidence for radical and carbocationic intermediates.
PubMed:Purification and properties of a secondary alcohol dehydrogenase from the parasitic protozoan Tritrichomonas foetus.
PubMed:Inactivation of quinoprotein alcohol dehydrogenases with cyclopropane-derived suicide substrates. .
PubMed:Purification and characterization of a nicotinamide adenine dinucleotide-dependent secondary alcohol dehydrogenase from Candida boidinii.
PubMed:A cyclobutanol intermediate in the decomposition of aldehydes under electron impact. A further photochemical analogy.
 
Notes:
None found
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