Home Halogens Methanone, (2-amino-4-chlorophenyl)phenyl-

Methanone, (2-amino-4-chlorophenyl)phenyl-

CAS No.:
4076-50-0
Catalog Number:
AG0075AL
Molecular Formula:
C13H10ClNO
Molecular Weight:
231.6776
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$59
- +
1g
98%
1 week
United States
$80
- +
Product Description
Catalog Number:
AG0075AL
Chemical Name:
Methanone, (2-amino-4-chlorophenyl)phenyl-
CAS Number:
4076-50-0
Molecular Formula:
C13H10ClNO
Molecular Weight:
231.6776
MDL Number:
MFCD00025193
IUPAC Name:
(2-amino-4-chlorophenyl)-phenylmethanone
InChI:
InChI=1S/C13H10ClNO/c14-10-6-7-11(12(15)8-10)13(16)9-4-2-1-3-5-9/h1-8H,15H2
InChI Key:
PELAWRHVRDOWQT-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)N)C(=O)c1ccccc1
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.045g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.679g/mol
Monoisotopic Mass:
231.045g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
Synthesis and evaluation of N1-substituted-3-propyl-1,4-benzodiazepine-2-ones as cholecystokinin (CCK2) receptor ligands. The Journal of pharmacy and pharmacology 20020601
Properties