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1020409-12-4 | 2-Pyridinecarboxylic acid, 3,4,5-trichloro-6-methoxy-
CAS No: 1020409-12-4 Catalog No: AG0006FW MDL No:MFCD27939564
Product Description
Catalog Number:
AG0006FW
Chemical Name:
2-Pyridinecarboxylic acid, 3,4,5-trichloro-6-methoxy-
CAS Number:
1020409-12-4
Molecular Formula:
C7H4Cl3NO3
Molecular Weight:
256.4706
MDL Number:
MFCD27939564
IUPAC Name:
3,4,5-trichloro-6-methoxypyridine-2-carboxylic acid
InChI:
InChI=1S/C7H4Cl3NO3/c1-14-6-4(10)2(8)3(9)5(11-6)7(12)13/h1H3,(H,12,13)
InChI Key:
HSFSHMRLKAQAIM-UHFFFAOYSA-N
SMILES:
COc1nc(C(=O)O)c(c(c1Cl)Cl)Cl
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.926g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.463g/mol
Monoisotopic Mass:
254.926g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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