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79881-37-1 | 3',5-dichlorobiphenyl-3-ol
CAS No: 79881-37-1 Catalog No: AG005FAE MDL No:
Product Description
Catalog Number:
AG005FAE
Chemical Name:
3',5-dichlorobiphenyl-3-ol
CAS Number:
79881-37-1
Molecular Formula:
C12H8Cl2O
Molecular Weight:
239.0973
IUPAC Name:
3-chloro-5-(3-chlorophenyl)phenol
InChI:
InChI=1S/C12H8Cl2O/c13-10-3-1-2-8(4-10)9-5-11(14)7-12(15)6-9/h1-7,15H
InChI Key:
PCDMWQLKNQIRNA-UHFFFAOYSA-N
SMILES:
Oc1cc(Cl)cc(c1)c1cccc(c1)Cl
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.995g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.095g/mol
Monoisotopic Mass:
237.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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