3-Methyl-4-decanol

Base Information

• Chemical Name: 3-Methyl-4-decanol
• CAS No.: 55816-17-6
• Molecular Formula: C₁₁H₂₄O
• Molecular Weight: 172.311
• DSSTox Substance ID: DTXSID70971218
• Nikkaji Number: J3.476.038A
• Mol file: 55816-17-6.mol

Synonyms:3-Methyl-4-decanol;55816-17-6;3-methyldecan-4-ol;2-Butyl n-hexyl carbinol;3-Methyl-4-decanol, erythro + threo;SCHEMBL4651557;DTXSID70971218;SBMFCRFCWMMVQC-UHFFFAOYSA-N;MFCD00046702;3-Methyl-4-decanol, threo + erythro;FT-0640340

Chemical Property of 3-Methyl-4-decanol

Chemical Property:

• Vapor Pressure: 0.02mmHg at 25°C
• Boiling Point: 223°Cat760mmHg
• PKA: 15.44±0.20(Predicted)
• Flash Point: 99.2°C
• Density: 0.826g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 172.182715385
• Heavy Atom Count: 12
• Complexity: 91

Purity/Quality:

98%Min ^*data from raw suppliers

3-METHYL-4-DECANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(C(C)CC)O