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1480756-80-6 | 3-(4-Chlorophenyl)-1H-pyrrole-2-carboxylic Acid
CAS No: 1480756-80-6 Catalog No: AG01FLL1 MDL No:
Product Description
Catalog Number:
AG01FLL1
Chemical Name:
3-(4-Chlorophenyl)-1H-pyrrole-2-carboxylic Acid
CAS Number:
1480756-80-6
IUPAC Name:
3-(4-chlorophenyl)-1H-pyrrole-2-carboxylic acid
InChI:
InChI=1S/C11H8ClNO2/c12-8-3-1-7(2-4-8)9-5-6-13-10(9)11(14)15/h1-6,13H,(H,14,15)
InChI Key:
GAAVTXOFWVEMGQ-UHFFFAOYSA-N
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.024g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.64g/mol
Monoisotopic Mass:
221.024g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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