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1260840-03-6 | Benzeneacetic acid, 4-amino-5-chloro-2-methoxy-
CAS No: 1260840-03-6 Catalog No: AG000REN MDL No:
Product Description
Catalog Number:
AG000REN
Chemical Name:
Benzeneacetic acid, 4-amino-5-chloro-2-methoxy-
CAS Number:
1260840-03-6
Molecular Formula:
C9H10ClNO3
Molecular Weight:
215.6336
IUPAC Name:
2-(4-amino-5-chloro-2-methoxyphenyl)acetic acid
InChI:
InChI=1S/C9H10ClNO3/c1-14-8-4-7(11)6(10)2-5(8)3-9(12)13/h2,4H,3,11H2,1H3,(H,12,13)
InChI Key:
XPFIZRIFZBFSOE-UHFFFAOYSA-N
SMILES:
COc1cc(N)c(cc1CC(=O)O)Cl
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.035g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.633g/mol
Monoisotopic Mass:
215.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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