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Home > Nitro Compounds > 78326-57-5
78326-57-5 | Urea,N-(1-methylethyl)-N-nitroso-N'-phenyl-
CAS No: 78326-57-5 Catalog No: AG005BZZ MDL No:
Product Description
Catalog Number:
AG005BZZ
Chemical Name:
Urea,N-(1-methylethyl)-N-nitroso-N'-phenyl-
CAS Number:
78326-57-5
Molecular Formula:
C10H13N3O2
Molecular Weight:
207.2291
IUPAC Name:
1-nitroso-3-phenyl-1-propan-2-ylurea
InChI:
InChI=1S/C10H13N3O2/c1-8(2)13(12-15)10(14)11-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,11,14)
InChI Key:
VBIPNWLRLREJNA-UHFFFAOYSA-N
SMILES:
CC(N(C(=O)Nc1ccccc1)N=O)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.101g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.233g/mol
Monoisotopic Mass:
207.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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