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197512-40-6 | a-(4-Chlorophenyl)-a-methyl-2-pyridine-methanol
CAS No: 197512-40-6 Catalog No: AG01F8BU MDL No:MFCD00034768
Product Description
Catalog Number:
AG01F8BU
Chemical Name:
a-(4-Chlorophenyl)-a-methyl-2-pyridine-methanol
CAS Number:
197512-40-6
Molecular Formula:
C13H12ClNO
Molecular Weight:
233.6935
MDL Number:
MFCD00034768
IUPAC Name:
1-(4-chlorophenyl)-1-pyridin-2-ylethanol
InChI:
InChI=1S/C13H12ClNO/c1-13(16,12-4-2-3-9-15-12)10-5-7-11(14)8-6-10/h2-9,16H,1H3
InChI Key:
MVGXHPOATKRSGF-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(c1ccccn1)(O)C
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.061g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.695g/mol
Monoisotopic Mass:
233.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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