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1351641-73-0 | 2-Amino-4-hydroxy-5-methoxybenzoic acid hydrochloride
CAS No: 1351641-73-0 Catalog No: AG01FMIB MDL No:MFCD21092080
Product Description
Catalog Number:
AG01FMIB
Chemical Name:
2-Amino-4-hydroxy-5-methoxybenzoic acid hydrochloride
CAS Number:
1351641-73-0
Molecular Formula:
C8H10ClNO4
Molecular Weight:
219.6223
MDL Number:
MFCD21092080
IUPAC Name:
2-amino-4-hydroxy-5-methoxybenzoic acid;hydrochloride
InChI:
InChI=1S/C8H9NO4.ClH/c1-13-7-2-4(8(11)12)5(9)3-6(7)10;/h2-3,10H,9H2,1H3,(H,11,12);1H
InChI Key:
LZGUJCOVUVZWEJ-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)O)c(cc1O)N.Cl
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.03g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
219.621g/mol
Monoisotopic Mass:
219.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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