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101907-41-9 | Carbamic acid, [4-(2-formylhydrazino)phenyl]-, phenyl ester (9CI)
CAS No: 101907-41-9 Catalog No: AG0005WK MDL No:
Product Description
Catalog Number:
AG0005WK
Chemical Name:
Carbamic acid, [4-(2-formylhydrazino)phenyl]-, phenyl ester (9CI)
CAS Number:
101907-41-9
Molecular Formula:
C14H13N3O3
Molecular Weight:
271.2713
IUPAC Name:
phenyl N-[4-(2-formylhydrazinyl)phenyl]carbamate
InChI:
InChI=1S/C14H13N3O3/c18-10-15-17-12-8-6-11(7-9-12)16-14(19)20-13-4-2-1-3-5-13/h1-10,17H,(H,15,18)(H,16,19)
InChI Key:
VOCRIYAYMCWKEV-UHFFFAOYSA-N
SMILES:
O=CNNc1ccc(cc1)NC(=O)Oc1ccccc1
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.096g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
271.276g/mol
Monoisotopic Mass:
271.096g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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