(E)-6-Methylhept-3-en-1-ol

Base Information

• Chemical Name: (E)-6-Methylhept-3-en-1-ol
• CAS No.: 1335-09-7
• Deprecated CAS: 87677-91-6
• Molecular Formula: C8 H18 O
• Molecular Weight: 128.24
• European Community (EC) Number: 272-640-0
• UNII: WA6ZUV6CN5
• DSSTox Substance ID: DTXSID00887555
• Nikkaji Number: J332.701I
• Wikidata: Q82866739
• Mol file: 1335-09-7.mol

Synonyms:(E)-6-Methylhept-3-en-1-ol;Heptenol, methyl-;3-Hepten-1-ol, 6-methyl-, (3E)-;68900-88-9;WA6ZUV6CN5;6-Methyl-6-hepten-2-ol;6-Hepten-2-ol, 6-methyl-;trans-6-Methyl-3-hepten-1-ol;EINECS 215-619-3;EINECS 272-640-0;6-Methyl-3-hepten-1-ol, (3E)-;UNII-WA6ZUV6CN5;SCHEMBL11108748;SCHEMBL15913906;(E)-6-Methyl-3-hepten-1-ol;DTXSID00887555;3-Hepten-1-ol, 6-methyl-, (E)-;LS-74678

Chemical Property of (E)-6-Methylhept-3-en-1-ol

Chemical Property:

• Vapor Pressure: 0.201mmHg at 25°C
• Melting Point: -31.5°C (estimate)
• Refractive Index: n20/D 1.448(lit.)
• Boiling Point: 182.4°Cat760mmHg
• Flash Point: 68.2°C
• PSA: 20.23000
• Density: 0.843g/cm³
• LogP: 2.11360
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 128.120115130
• Heavy Atom Count: 9
• Complexity: 74.6

Purity/Quality:

99.0%Min ^*data from raw suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 40
• Safety Statements: 36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CC=CCCO
• Isomeric SMILES: CC(C)C/C=C/CCO