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Home > Imidazoles > 1456404-92-4
1456404-92-4 | phenyl N-[2-(1H-imidazol-1-yl)phenyl]carbamate
CAS No: 1456404-92-4 Catalog No: AG01C09A MDL No:MFCD30497884
Product Description
Catalog Number:
AG01C09A
Chemical Name:
phenyl N-[2-(1H-imidazol-1-yl)phenyl]carbamate
CAS Number:
1456404-92-4
Molecular Formula:
C16H13N3O2
Molecular Weight:
279.2933
MDL Number:
MFCD30497884
IUPAC Name:
phenyl N-(2-imidazol-1-ylphenyl)carbamate
InChI:
InChI=1S/C16H13N3O2/c20-16(21-13-6-2-1-3-7-13)18-14-8-4-5-9-15(14)19-11-10-17-12-19/h1-12H,(H,18,20)
InChI Key:
AGXJWSJGZSEYJD-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1n1ccnc1)Oc1ccccc1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.101g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.299g/mol
Monoisotopic Mass:
279.101g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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