(6S)-6-methyloctan-1-ol

Base Information

• Chemical Name: (6S)-6-methyloctan-1-ol
• CAS No.: 110453-78-6
• Molecular Formula: C₉H₂₀O
• Molecular Weight: 144.257
• Hs Code.: 29051990
• DSSTox Substance ID: DTXSID70543499
• Nikkaji Number: J1.490.298H
• Wikidata: Q27156553
• Mol file: 110453-78-6.mol

Synonyms:110453-78-6;(S)-(+)-6-Methyl-1-octanol;(S)-6-methyloctan-1-ol;(6S)-6-methyloctan-1-ol;1-Octanol, 6-methyl-,(6S)-;1-Octanol, 6-methyl-, (S)-;(S)-6-Methyl-1-octanol;6-Methyl-1-octanol #;(6S)-6-Methyl-1-octanol;(6s)-6-meth-yloctan-1-ol;SCHEMBL4288193;CHEBI:83010;DTXSID70543499;MFCD00221493;AKOS006343463;AKOS015840005;M0966;T71591;J-002430;Q27156553

Chemical Property of (6S)-6-methyloctan-1-ol

Chemical Property:

• Vapor Pressure: 0.102mmHg at 25°C
• Refractive Index: 1.4320-1.4360
• Boiling Point: 196.6°Cat760mmHg
• PKA: 15.20±0.10(Predicted)
• Flash Point: 79.5°C
• PSA: 20.23000
• Density: 0.824g/cm³
• LogP: 2.58520
• Storage Temp.: 2-8°C
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 144.151415257
• Heavy Atom Count: 10
• Complexity: 61.7

Purity/Quality:

98%,99%, ^*data from raw suppliers

(s)-(+)-6-Methyl-1-octanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)CCCCCO
• Isomeric SMILES: CC[C@H](C)CCCCCO