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133330-60-6 | 11H-Benzo[5,6]cyclohepta[1,2-b]pyridin-11-one, 4,8-dichloro-5,6-dihydro-
CAS No: 133330-60-6 Catalog No: AG0014NQ MDL No:
Product Description
Catalog Number:
AG0014NQ
Chemical Name:
11H-Benzo[5,6]cyclohepta[1,2-b]pyridin-11-one, 4,8-dichloro-5,6-dihydro-
CAS Number:
133330-60-6
Molecular Formula:
C14H9Cl2NO
Molecular Weight:
278.1334
IUPAC Name:
7,13-dichloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-2-one
InChI:
InChI=1S/C14H9Cl2NO/c15-9-2-4-10-8(7-9)1-3-11-12(16)5-6-17-13(11)14(10)18/h2,4-7H,1,3H2
InChI Key:
FCKZNHVKGINCEC-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)CCc1c(C2=O)nccc1Cl
UNII:
U665LG9V5L
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.006g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.132g/mol
Monoisotopic Mass:
277.006g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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