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1248403-10-2 | 3,4-Dichlorophenyl-(3-thienyl)methanol
CAS No: 1248403-10-2 Catalog No: AG01FCL0 MDL No:
Product Description
Catalog Number:
AG01FCL0
Chemical Name:
3,4-Dichlorophenyl-(3-thienyl)methanol
CAS Number:
1248403-10-2
Molecular Formula:
C11H8Cl2OS
Molecular Weight:
259.1516
IUPAC Name:
(3,4-dichlorophenyl)-thiophen-3-ylmethanol
InChI:
InChI=1S/C11H8Cl2OS/c12-9-2-1-7(5-10(9)13)11(14)8-3-4-15-6-8/h1-6,11,14H
InChI Key:
FYCJOZIXOHTJQQ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1Cl)C(c1cscc1)O
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.967g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.144g/mol
Monoisotopic Mass:
257.967g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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