butyl(3-hydroxypropyl)nitrosamine

Modify Date: 2025-08-27 13:27:04

butyl(3-hydroxypropyl)nitrosamine Structure
butyl(3-hydroxypropyl)nitrosamine structure
Common Name butyl(3-hydroxypropyl)nitrosamine
CAS Number 51938-13-7 Molecular Weight 160.21400
Density 1.03g/cm3 Boiling Point 313ºC at 760mmHg
Molecular Formula C7H16N2O2 Melting Point N/A
MSDS N/A Flash Point 143.1ºC

 Names

Name N-butyl-N-(3-hydroxypropyl)nitrous amide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.03g/cm3
Boiling Point 313ºC at 760mmHg
Molecular Formula C7H16N2O2
Molecular Weight 160.21400
Flash Point 143.1ºC
Exact Mass 160.12100
PSA 52.90000
LogP 1.15230
Index of Refraction 1.473
InChIKey NXTAUOKPRBKNBV-UHFFFAOYSA-N
SMILES CCCCN(CCCO)N=O

 Synthetic Route

~%

butyl(3-hydroxypropyl)nitrosamine Structure

butyl(3-hydroxy...

CAS#:51938-13-7

Literature: Okada; Suzuki; Iiyoshi Chemical and Pharmaceutical Bulletin, 1978 , vol. 26, # 12 p. 3891 - 3896

 butyl(3-hydroxypropyl)nitrosamineBioassay

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Name: Carcinogenic potency modelled in silico, (- = non-carcinogen)
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL842270
Name: The compound was modelled in silico for carcinogenic potency; + = Carcinogen
Source: ChEMBL
Target: N/A
External Id: CHEMBL842269
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 Synonyms

BHPN
1-Propanol,3-(butylnitrosoamino)
Butyl(3-hydroxypropyl)nitrosamine
3-(Butylnitrosoamino)-1-propanol
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