Home Halogens 7-chloro-3,4-dihydro-1H-benzo[b]azepine-2,5-dione

7-chloro-3,4-dihydro-1H-benzo[b]azepine-2,5-dione

CAS No.:
80452-55-7
Catalog Number:
AG01DJMB
Molecular Formula:
C10H8ClNO2
Molecular Weight:
209.6290
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Product Description
Catalog Number:
AG01DJMB
Chemical Name:
7-chloro-3,4-dihydro-1H-benzo[b]azepine-2,5-dione
CAS Number:
80452-55-7
Molecular Formula:
C10H8ClNO2
Molecular Weight:
209.6290
MDL Number:
MFCD15142749
IUPAC Name:
7-chloro-3,4-dihydro-1H-1-benzazepine-2,5-dione
InChI:
InChI=1S/C10H8ClNO2/c11-6-1-2-8-7(5-6)9(13)3-4-10(14)12-8/h1-2,5H,3-4H2,(H,12,14)
InChI Key:
YRUGIDNPYWLNBV-UHFFFAOYSA-N
SMILES:
O=C1CCC(=O)c2c(N1)ccc(c2)Cl
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.024g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.629g/mol
Monoisotopic Mass:
209.024g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties