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1286274-46-1 | N-[(1R*,4R*)-4-Aminocyclohexyl]benzamidehydrochloride
CAS No: 1286274-46-1 Catalog No: AG01F87W MDL No:
Product Description
Catalog Number:
AG01F87W
Chemical Name:
N-[(1R*,4R*)-4-Aminocyclohexyl]benzamidehydrochloride
CAS Number:
1286274-46-1
Molecular Formula:
C13H19ClN2O
Molecular Weight:
254.7558
IUPAC Name:
N-(4-aminocyclohexyl)benzamide;hydrochloride
InChI:
InChI=1S/C13H18N2O.ClH/c14-11-6-8-12(9-7-11)15-13(16)10-4-2-1-3-5-10;/h1-5,11-12H,6-9,14H2,(H,15,16);1H
InChI Key:
WKRLFLWPVJUECV-UHFFFAOYSA-N
SMILES:
N[C@@H]1CC[C@H](CC1)NC(=O)c1ccccc1.Cl
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.119g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
254.758g/mol
Monoisotopic Mass:
254.119g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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