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17361-89-6 | 2-Thiophenecarbonyl chloride, 5-phenyl-
CAS No: 17361-89-6 Catalog No: AG001Z31 MDL No:
Product Description
Catalog Number:
AG001Z31
Chemical Name:
2-Thiophenecarbonyl chloride, 5-phenyl-
CAS Number:
17361-89-6
Molecular Formula:
C11H7ClOS
Molecular Weight:
222.6907
IUPAC Name:
5-phenylthiophene-2-carbonyl chloride
InChI:
InChI=1S/C11H7ClOS/c12-11(13)10-7-6-9(14-10)8-4-2-1-3-5-8/h1-7H
InChI Key:
DAQWIBBCMYIUFA-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(s1)c1ccccc1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.991g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.686g/mol
Monoisotopic Mass:
221.991g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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