N,N-bis(2-hydroxypropyl)nitrosamine (CHEBI:131518)

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ChEBI Name	N,N-bis(2-hydroxypropyl)nitrosamine

ChEBI ID	CHEBI:131518

ChEBI ASCII Name	N,N-bis(2-hydroxypropyl)nitrosamine

Definition	A nitrosamine that is dipropylamine in which the hydrogen attached to the nitrogen has been replaced by a nitroso group. It is a genotoxic carcinogen, targeting the lung, liver, thyroid, and kidney.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C6H14N2O3

Net Charge

Average Mass

162.187

Monoisotopic Mass

162.10044

InChI

InChI=1S/C6H14N2O3/c1-5(9)3-8(7-11)4-6(2)10/h5-6,9-10H,3-4H2,1-2H3

InChIKey

MNIGYIKCFSPQRJ-UHFFFAOYSA-N

SMILES

CC(CN(CC(C)O)N=O)O

Roles Classification
Biological Role(s):	carcinogenic agent A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.

ChEBI Ontology
Outgoing	N,N-bis(2-hydroxypropyl)nitrosamine (CHEBI:131518) has role carcinogenic agent (CHEBI:50903) N,N-bis(2-hydroxypropyl)nitrosamine (CHEBI:131518) is a diol (CHEBI:23824) N,N-bis(2-hydroxypropyl)nitrosamine (CHEBI:131518) is a nitrosamine (CHEBI:35803) N,N-bis(2-hydroxypropyl)nitrosamine (CHEBI:131518) is a secondary alcohol (CHEBI:35681)

Incoming	N-nitrobis(2-hydroxypropyl)amine (CHEBI:140063) has functional parent N,N-bis(2-hydroxypropyl)nitrosamine (CHEBI:131518)

IUPAC Name

N,N-bis(2-hydroxypropyl)nitrous amide

Synonyms	Sources
2,2'-bishydroxypropylnitrosamine	ChemIDplus
2,2'-dihydroxy-di-n-propylnitrosoamine	ChemIDplus
DHPN	ChemIDplus
di(2-hydroxypropyl)nitrosamine	ChemIDplus
diisopropanolnitrosamine	ChemIDplus
N,N-di-(2-hydroxypropyl)nitrosamine	ChemIDplus
N-bis(2-hydroxypropyl)nitrosamine	ChemIDplus
N-nitroso-N,N-di(2-hydroxypropyl)amine	ChemIDplus
N-nitrosobis(2-hydroxypropyl)amine	ChemIDplus
N-nitrosodiisopropanolamine	ChEBI

Last Modified

08 February 2018