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N-NITROSO-DI-ISO-PROPYLAMINE

CAS No.:
601-77-4
Catalog Number:
AG00EAO3
Molecular Formula:
C6H14N2O
Molecular Weight:
130.1882
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Product Description
Catalog Number:
AG00EAO3
Chemical Name:
N-NITROSO-DI-ISO-PROPYLAMINE
CAS Number:
601-77-4
Molecular Formula:
C6H14N2O
Molecular Weight:
130.1882
MDL Number:
MFCD00015392
IUPAC Name:
N,N-di(propan-2-yl)nitrous amide
InChI:
InChI=1S/C6H14N2O/c1-5(2)8(7-9)6(3)4/h5-6H,1-4H3
InChI Key:
AUIKJTGFPFLMFP-UHFFFAOYSA-N
SMILES:
CC(N(C(C)C)N=O)C
UNII:
AFI1E104OF
NSC Number:
336
Properties
Complexity:
83.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.111g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.191g/mol
Monoisotopic Mass:
130.111g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Mutagenesis by exocyclic alkylamino purine adducts in Escherichia coli. Mutation research 20060725
Properties