2-Nitro-3-heptanol

Base Information

• Chemical Name: 2-Nitro-3-heptanol
• CAS No.: 61097-77-6
• Molecular Formula: C₇H₁₅NO₃
• Molecular Weight: 161.201
• DSSTox Substance ID: DTXSID20462207
• Nikkaji Number: J2.648.166J
• Mol file: 61097-77-6.mol

Synonyms:2-nitro-3-heptanol;61097-77-6;SCHEMBL2833774;DTXSID20462207;BJKHKPOTYLELSH-UHFFFAOYSA-N

Chemical Property of 2-Nitro-3-heptanol

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 161.10519334
• Heavy Atom Count: 11
• Complexity: 121

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C(C)[N+](=O)[O-])O