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1020327-61-0 | Carbamic acid, N-3-pyridazinyl-, phenyl ester
CAS No: 1020327-61-0 Catalog No: AG0006EI MDL No:
Product Description
Catalog Number:
AG0006EI
Chemical Name:
Carbamic acid, N-3-pyridazinyl-, phenyl ester
CAS Number:
1020327-61-0
Molecular Formula:
C11H9N3O2
Molecular Weight:
215.2081
IUPAC Name:
phenyl N-pyridazin-3-ylcarbamate
InChI:
InChI=1S/C11H9N3O2/c15-11(13-10-7-4-8-12-14-10)16-9-5-2-1-3-6-9/h1-8H,(H,13,14,15)
InChI Key:
QPZCSARPVJAGQW-UHFFFAOYSA-N
SMILES:
O=C(Oc1ccccc1)Nc1cccnn1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.069g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.212g/mol
Monoisotopic Mass:
215.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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