200,000+ products from a single source!
sales@angenechem.com
15089-78-8 | Benzoic acid, 2-amino-4,5-dimethyl-, hydrochloride (1:1)
CAS No: 15089-78-8 Catalog No: AG001MXT MDL No:
Product Description
Catalog Number:
AG001MXT
Chemical Name:
Benzoic acid, 2-amino-4,5-dimethyl-, hydrochloride (1:1)
CAS Number:
15089-78-8
Molecular Formula:
C9H12ClNO2
Molecular Weight:
201.6501
IUPAC Name:
2-amino-4,5-dimethylbenzoic acid;hydrochloride
InChI:
InChI=1S/C9H11NO2.ClH/c1-5-3-7(9(11)12)8(10)4-6(5)2;/h3-4H,10H2,1-2H3,(H,11,12);1H
InChI Key:
GRUYXGPRCPWUKX-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(C)c(cc1N)C.Cl
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.056g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
201.65g/mol
Monoisotopic Mass:
201.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.