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893739-08-7 | [1,1'-Biphenyl]-3-methanol,4'-(methylsulfonyl)-
CAS No: 893739-08-7 Catalog No: AG003WNO MDL No:
Product Description
Catalog Number:
AG003WNO
Chemical Name:
[1,1'-Biphenyl]-3-methanol,4'-(methylsulfonyl)-
CAS Number:
893739-08-7
Molecular Formula:
C14H14O3S
Molecular Weight:
262.3242
IUPAC Name:
[3-(4-methylsulfonylphenyl)phenyl]methanol
InChI:
InChI=1S/C14H14O3S/c1-18(16,17)14-7-5-12(6-8-14)13-4-2-3-11(9-13)10-15/h2-9,15H,10H2,1H3
InChI Key:
OFGDMSDHGKLGMR-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1)c1ccc(cc1)S(=O)(=O)C
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.066g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.323g/mol
Monoisotopic Mass:
262.066g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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