3-[(Ethylthio)methyl]heptane

Base Information

• Chemical Name: 3-[(Ethylthio)methyl]heptane
• CAS No.: 71607-39-1
• Molecular Formula: C10H22 S
• Molecular Weight: 174.34668
• European Community (EC) Number: 275-680-7
• DSSTox Substance ID: DTXSID70992165
• Nikkaji Number: J298.950F
• Mol file: 71607-39-1.mol

Synonyms:71607-39-1;EINECS 275-680-7;3-[(ETHYLTHIO)METHYL]HEPTANE;3-((Ethylthio)methyl)heptane;SCHEMBL15270944;3-[(Ethylsulfanyl)methyl]heptane;DTXSID70992165

Chemical Property of 3-[(Ethylthio)methyl]heptane

Chemical Property:

• Vapor Pressure: 0.165mmHg at 25°C
• Boiling Point: 220.8°C at 760 mmHg
• Flash Point: 85.4°C
• PSA: 25.30000
• Density: 0.838g/cm³
• LogP: 3.95590
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 174.14422188
• Heavy Atom Count: 11
• Complexity: 71.3

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)CSCC