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113546-44-4 | Urea, N-chloro-N'-phenyl-
CAS No: 113546-44-4 Catalog No: AG0008YJ MDL No:
Product Description
Catalog Number:
AG0008YJ
Chemical Name:
Urea, N-chloro-N'-phenyl-
CAS Number:
113546-44-4
Molecular Formula:
C7H7ClN2O
Molecular Weight:
170.5963
IUPAC Name:
1-chloro-3-phenylurea
InChI:
InChI=1S/C7H7ClN2O/c8-10-7(11)9-6-4-2-1-3-5-6/h1-5H,(H2,9,10,11)
InChI Key:
ULYSMQORPOQZCP-UHFFFAOYSA-N
SMILES:
ClNC(=O)Nc1ccccc1
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
170.596g/mol
Monoisotopic Mass:
170.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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