Home Aminos 4-{[(2-methylphenyl)methyl]amino}benzoic acid hydrochloride

4-{[(2-methylphenyl)methyl]amino}benzoic acid hydrochloride

CAS No.:
1172716-00-5
Catalog Number:
AG019N7O
Molecular Formula:
C15H16ClNO2
Molecular Weight:
277.7460
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Product Description
Catalog Number:
AG019N7O
Chemical Name:
4-{[(2-methylphenyl)methyl]amino}benzoic acid hydrochloride
CAS Number:
1172716-00-5
Molecular Formula:
C15H16ClNO2
Molecular Weight:
277.7460
MDL Number:
MFCD11505490
IUPAC Name:
4-[(2-methylphenyl)methylamino]benzoic acid;hydrochloride
InChI:
InChI=1S/C15H15NO2.ClH/c1-11-4-2-3-5-13(11)10-16-14-8-6-12(7-9-14)15(17)18;/h2-9,16H,10H2,1H3,(H,17,18);1H
InChI Key:
ZKHHEXPUUUUMOU-UHFFFAOYSA-N
SMILES:
Cc1ccccc1CNc1ccc(cc1)C(=O)O.Cl
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.087g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
277.748g/mol
Monoisotopic Mass:
277.087g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties