Methyl 4-Amino-5-chloro-2-hydroxybenzoate - CAS 129511-06-4
Catalog: |
BB006998 |
Product Name: |
Methyl 4-Amino-5-chloro-2-hydroxybenzoate |
CAS: |
129511-06-4 |
Synonyms: |
4-amino-5-chloro-2-hydroxybenzoic acid methyl ester; methyl 4-amino-5-chloro-2-hydroxybenzoate |
IUPAC Name: | methyl 4-amino-5-chloro-2-hydroxybenzoate |
Description: | Methyl 4-Amino-5-chloro-2-hydroxybenzoate (CAS# 129511-06-4 ) is a useful research chemical. |
Molecular Weight: | 201.61 |
Molecular Formula: | C8H8ClNO3 |
Canonical SMILES: | COC(=O)C1=CC(=C(C=C1O)N)Cl |
InChI: | InChI=1S/C8H8ClNO3/c1-13-8(12)4-2-5(9)6(10)3-7(4)11/h2-3,11H,10H2,1H3 |
InChI Key: | SXMFZXQWMHJMOH-UHFFFAOYSA-N |
LogP: | 1.99560 |
Publication Number | Title | Priority Date |
WO-2010077915-A1 | Novel compounds useful as cc chemokine receptor ligands | 20081217 |
EP-1723110-A1 | Biphenyl compounds useful as muscarinic receptor antagonists | 20040311 |
JP-2007528416-A | Useful biphenyl compounds as muscarinic receptor antagonists | 20040311 |
US-2005203139-A1 | Biphenyl compounds useful as muscarinic receptor antagonists | 20040311 |
US-2009048299-A1 | Biphenyl compounds useful as muscarinic receptor antagonists | 20040311 |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.0192708 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.0192708 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 72.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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