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191090-84-3 | 2(1H)-Pyridinone, 4-[(4-chlorophenyl)methoxy]-
CAS No: 191090-84-3 Catalog No: AG002F1B MDL No:
Product Description
Catalog Number:
AG002F1B
Chemical Name:
2(1H)-Pyridinone, 4-[(4-chlorophenyl)methoxy]-
CAS Number:
191090-84-3
Molecular Formula:
C12H10ClNO2
Molecular Weight:
235.6663
IUPAC Name:
4-[(4-chlorophenyl)methoxy]-1H-pyridin-2-one
InChI:
InChI=1S/C12H10ClNO2/c13-10-3-1-9(2-4-10)8-16-11-5-6-14-12(15)7-11/h1-7H,8H2,(H,14,15)
InChI Key:
AYZIQENJFUPTMZ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)COc1cc[nH]c(=O)c1
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.04g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.667g/mol
Monoisotopic Mass:
235.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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