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Home > Nitro Compounds > 127158-46-7
127158-46-7 | Hydrazinecarboxamide, N,2-bis(2-chloroethyl)-2-methyl-N-nitroso-
CAS No: 127158-46-7 Catalog No: AG000WPC MDL No:
Product Description
Catalog Number:
AG000WPC
Chemical Name:
Hydrazinecarboxamide, N,2-bis(2-chloroethyl)-2-methyl-N-nitroso-
CAS Number:
127158-46-7
Molecular Formula:
C6H12Cl2N4O2
Molecular Weight:
243.0911
IUPAC Name:
1-(2-chloroethyl)-3-[2-chloroethyl(methyl)amino]-1-nitrosourea
InChI:
InChI=1S/C6H12Cl2N4O2/c1-11(4-2-7)9-6(13)12(10-14)5-3-8/h2-5H2,1H3,(H,9,13)
InChI Key:
SXBPVGJLMLWEAP-UHFFFAOYSA-N
SMILES:
ClCCN(NC(=O)N(CCCl)N=O)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.034g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.088g/mol
Monoisotopic Mass:
242.034g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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