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944652-71-5 | 3-Chlorophenyl-(5-methyl-2-thienyl)methanol
CAS No: 944652-71-5 Catalog No: AG01EZIR MDL No:
Product Description
Catalog Number:
AG01EZIR
Chemical Name:
3-Chlorophenyl-(5-methyl-2-thienyl)methanol
CAS Number:
944652-71-5
Molecular Formula:
C12H11ClOS
Molecular Weight:
238.7331
IUPAC Name:
(3-chloro-5-methylthiophen-2-yl)-phenylmethanol
InChI:
InChI=1S/C12H11ClOS/c1-8-7-10(13)12(15-8)11(14)9-5-3-2-4-6-9/h2-7,11,14H,1H3
InChI Key:
YNEBVQXLFKAENG-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)C(c1ccc(s1)C)O
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.022g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.729g/mol
Monoisotopic Mass:
238.022g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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