Home Halogens 2-Amino-5-chloro-4-methoxy-benzoic acid

2-Amino-5-chloro-4-methoxy-benzoic acid

CAS No.:
79025-82-4
Catalog Number:
AG00G86T
Molecular Formula:
C8H8ClNO3
Molecular Weight:
201.6070
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Product Description
Catalog Number:
AG00G86T
Chemical Name:
2-Amino-5-chloro-4-methoxy-benzoic acid
CAS Number:
79025-82-4
Molecular Formula:
C8H8ClNO3
Molecular Weight:
201.6070
MDL Number:
MFCD05665825
IUPAC Name:
2-amino-5-chloro-4-methoxybenzoic acid
InChI:
InChI=1S/C8H8ClNO3/c1-13-7-3-6(10)4(8(11)12)2-5(7)9/h2-3H,10H2,1H3,(H,11,12)
InChI Key:
VJLREPGGNOEDCE-UHFFFAOYSA-N
SMILES:
COc1cc(N)c(cc1Cl)C(=O)O
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.019g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
201.606g/mol
Monoisotopic Mass:
201.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties