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119876-18-5 | Urea, N-(2-chloroethyl)-N'-nitroso-
CAS No: 119876-18-5 Catalog No: AG000PSK MDL No:
Product Description
Catalog Number:
AG000PSK
Chemical Name:
Urea, N-(2-chloroethyl)-N'-nitroso-
CAS Number:
119876-18-5
Molecular Formula:
C3H6ClN3O2
Molecular Weight:
151.5516
IUPAC Name:
1-(2-chloroethyl)-3-nitrosourea
InChI:
InChI=1S/C3H6ClN3O2/c4-1-2-5-3(8)6-7-9/h1-2H2,(H2,5,6,8,9)
InChI Key:
KFVXPKCLAGCJRX-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)NN=O
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.015g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
151.55g/mol
Monoisotopic Mass:
151.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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