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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 190045Generated: November 4, 2026

Butanoic acid, 4-((4-hydroxybutyl)nitrosoamino)-, methyl ester

https://huagongshe.com/en/chemical/190045

Butanoic acid, 4-((4-hydroxybutyl)nitrosoamino)-, methyl ester molecular structure

Identifiers & Physical Properties

CAS No.79448-04-7
Molecular formulaC9H18N2O4
Average molar mass218.25 g/mol
Monoisotopic mass218.12665706 g/mol
SMILESCOC(=O)CCCN(CCCCO)N=O
InChIKeyWFMJCEHMEOYUIC-UHFFFAOYSA-N
PubChem CID190045
DTXSIDDTXSID90229662

Chemical & Physical Properties

XLogP0.4
Topological polar surface area79.2
Hydrogen bond donors1
Hydrogen bond acceptors6
Rotatable bonds9
Heavy atoms15
Formal charge0
Complexity187