3-Hydroxybutyl nitrate

Base Information

• Chemical Name: 3-Hydroxybutyl nitrate
• CAS No.: 141299-18-5
• Molecular Formula: C4H9NO4
• DSSTox Substance ID: DTXSID901335130

Synonyms:3-hydroxybutyl nitrate;141299-18-5;4-Nitrooxy-2-butanol;SCHEMBL18243623;nitric acid 3-hydroxy-butyl ester;DTXSID901335130

Chemical Property of 3-Hydroxybutyl nitrate

Chemical Property:

• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 135.05315777
• Heavy Atom Count: 9
• Complexity: 89.1

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Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CCO[N+](=O)[O-])O

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