N-Butyl-N-(3-carboxypropyl)nitrosamine
-
N-Butyl-N-(3-carboxypropyl)nitrosamine
structure -
-
CAS No:
38252-74-3
-
Formula:
C8H16N2O3
-
Chemical Name:
N-Butyl-N-(3-carboxypropyl)nitrosamine
-
Synonyms:
Butanoic acid,4-(butylnitrosoamino)-;4-(Butylnitrosoamino)butanoic acid;Butyl(3-carboxypropyl)nitrosamine;N-Butyl-N-(3-carboxypropyl)nitrosamine
-
CAS No:
Description
ChEBI: A nitrosamine that has butyl and 4-carboxybutyl substituents. It is the principal metabolite of the bladder carcinogen N-butyl-N-(4-hydroxybutyl)nitrosamine (BHBN-4).
N-butyl-N-(3-carboxypropyl)nitrosamine is a nitrosamine that has butyl and 4-carboxybutyl substituents. It is the principal metabolite of the bladder carcinogen N-butyl-N-(4-hydroxybutyl)nitrosamine (BHBN-4). It has a role as a carcinogenic agent. It is a nitrosamine and a monocarboxylic acid. It derives from a N-butyl-N-(4-hydroxybutyl)nitrosamine.
Characteristics
70
1.63470
1.12g/cm3
39-40 °C
381.2ºC at 760mmHg
184.4ºC
1.493
0-10°C
Thermal decomposition to emit toxic nitrogen oxide fumes
Safety Information
ES8125000
Warehouse ventilation, low temperature and dry
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Drug Information
Substances that increase the risk of NEOPLASMS in humans or animals. Both genotoxic chemicals, which affect DNA directly, and nongenotoxic chemicals, which induce neoplasms by other mechanism, are included. (See all compounds classified as Carcinogens.)
BCPN
Computed Properties
Molecular Weight:188.22
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:188.11609238
Monoisotopic Mass:188.11609238
Topological Polar Surface Area:70
Heavy Atom Count:13
Complexity:162
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
N-Butyl-N-(3-carboxypropyl)nitrosamine
SDSRequest for Quotation