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1789-30-6 | Methanone, (2-amino-5-chlorophenyl)cyclohexyl-
CAS No: 1789-30-6 Catalog No: AG0026HN MDL No:
Product Description
Catalog Number:
AG0026HN
Chemical Name:
Methanone, (2-amino-5-chlorophenyl)cyclohexyl-
CAS Number:
1789-30-6
Molecular Formula:
C13H16ClNO
Molecular Weight:
237.7252
IUPAC Name:
(2-amino-5-chlorophenyl)-cyclohexylmethanone
InChI:
InChI=1S/C13H16ClNO/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h6-9H,1-5,15H2
InChI Key:
XCKJMNZTSNFNHE-UHFFFAOYSA-N
SMILES:
O=C(c1cc(Cl)ccc1N)C1CCCCC1
EC Number:
217-252-4
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.092g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.727g/mol
Monoisotopic Mass:
237.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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