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61494-55-1 | 2-CHLORO-3-PYRIDINEACETIC ACID
CAS No: 61494-55-1 Catalog No: AG0038LM MDL No:MFCD09757512
Product Description
Catalog Number:
AG0038LM
Chemical Name:
2-CHLORO-3-PYRIDINEACETIC ACID
CAS Number:
61494-55-1
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
MDL Number:
MFCD09757512
IUPAC Name:
2-(2-chloropyridin-3-yl)acetic acid
InChI:
InChI=1S/C7H6ClNO2/c8-7-5(4-6(10)11)2-1-3-9-7/h1-3H,4H2,(H,10,11)
InChI Key:
NOASBJYTBZMVKT-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cccnc1Cl
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.58g/mol
Monoisotopic Mass:
171.009g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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