Home Aminos methyl 3-amino-2-(methylamino)benzoate hydrochloride

methyl 3-amino-2-(methylamino)benzoate hydrochloride

CAS No.:
2138136-21-5
Catalog Number:
AG01C8Z1
Molecular Formula:
C9H13ClN2O2
Molecular Weight:
216.6647
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Product Description
Catalog Number:
AG01C8Z1
Chemical Name:
methyl 3-amino-2-(methylamino)benzoate hydrochloride
CAS Number:
2138136-21-5
Molecular Formula:
C9H13ClN2O2
Molecular Weight:
216.6647
MDL Number:
MFCD31443742
IUPAC Name:
methyl 3-amino-2-(methylamino)benzoate;hydrochloride
InChI:
InChI=1S/C9H12N2O2.ClH/c1-11-8-6(9(12)13-2)4-3-5-7(8)10;/h3-5,11H,10H2,1-2H3;1H
InChI Key:
INWJWDJJBYWDRF-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1NC)N.Cl
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
216.665g/mol
Monoisotopic Mass:
216.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties