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1882-70-8 | Benzoic acid, 2-amino-5-methoxy-, hydrochloride (1:1)
CAS No: 1882-70-8 Catalog No: AG002GRP MDL No:MFCD00099225
Product Description
Catalog Number:
AG002GRP
Chemical Name:
Benzoic acid, 2-amino-5-methoxy-, hydrochloride (1:1)
CAS Number:
1882-70-8
Molecular Formula:
C8H10ClNO3
Molecular Weight:
203.6229
MDL Number:
MFCD00099225
IUPAC Name:
2-amino-5-methoxybenzoic acid;hydrochloride
InChI:
InChI=1S/C8H9NO3.ClH/c1-12-5-2-3-7(9)6(4-5)8(10)11;/h2-4H,9H2,1H3,(H,10,11);1H
InChI Key:
OZYJEEJZNNXJDU-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C(=O)O)N.Cl
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.035g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
203.622g/mol
Monoisotopic Mass:
203.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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