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1250544-44-5 | 3,4-Dichlorophenyl-(5-methyl-2-thienyl)methanol
CAS No: 1250544-44-5 Catalog No: AG01F9S5 MDL No:
Product Description
Catalog Number:
AG01F9S5
Chemical Name:
3,4-Dichlorophenyl-(5-methyl-2-thienyl)methanol
CAS Number:
1250544-44-5
Molecular Formula:
C12H10Cl2OS
Molecular Weight:
273.1782
IUPAC Name:
(3,4-dichlorophenyl)-(5-methylthiophen-2-yl)methanol
InChI:
InChI=1S/C12H10Cl2OS/c1-7-2-5-11(16-7)12(15)8-3-4-9(13)10(14)6-8/h2-6,12,15H,1H3
InChI Key:
OJBNSDGUSMOPMX-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)C(c1ccc(c(c1)Cl)Cl)O
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.983g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.171g/mol
Monoisotopic Mass:
271.983g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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