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1261991-24-5 | [1,1'-Biphenyl]-4-ol, 3-chloro-4'-(methylsulfonyl)-
CAS No: 1261991-24-5 Catalog No: AG000SBP MDL No:MFCD18315763
Product Description
Catalog Number:
AG000SBP
Chemical Name:
[1,1'-Biphenyl]-4-ol, 3-chloro-4'-(methylsulfonyl)-
CAS Number:
1261991-24-5
Molecular Formula:
C13H11ClO3S
Molecular Weight:
282.7426
MDL Number:
MFCD18315763
IUPAC Name:
2-chloro-4-(4-methylsulfonylphenyl)phenol
InChI:
InChI=1S/C13H11ClO3S/c1-18(16,17)11-5-2-9(3-6-11)10-4-7-13(15)12(14)8-10/h2-8,15H,1H3
InChI Key:
KFMZWXVTUIQXHG-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1Cl)c1ccc(cc1)S(=O)(=O)C
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.012g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
282.738g/mol
Monoisotopic Mass:
282.012g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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