Home Aminos Benzoic acid, 2-amino-3,5-dimethoxy-

Benzoic acid, 2-amino-3,5-dimethoxy-

CAS No.:
79263-00-6
Catalog Number:
AG008MK9
Molecular Formula:
C9H11NO4
Molecular Weight:
197.1879
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Product Description
Catalog Number:
AG008MK9
Chemical Name:
Benzoic acid, 2-amino-3,5-dimethoxy-
CAS Number:
79263-00-6
Molecular Formula:
C9H11NO4
Molecular Weight:
197.1879
MDL Number:
MFCD12159987
IUPAC Name:
2-amino-3,5-dimethoxybenzoic acid
InChI:
InChI=1S/C9H11NO4/c1-13-5-3-6(9(11)12)8(10)7(4-5)14-2/h3-4H,10H2,1-2H3,(H,11,12)
InChI Key:
OACFQDBLYWKDMK-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1)C(=O)O)N
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.19g/mol
Monoisotopic Mass:
197.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties