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39098-97-0 | 2-(Thiophen-2-yl)acetyl chloride
CAS No: 39098-97-0 Catalog No: AG003HY7 MDL No:MFCD00005456
Product Description
Catalog Number:
AG003HY7
Chemical Name:
2-(Thiophen-2-yl)acetyl chloride
CAS Number:
39098-97-0
Molecular Formula:
C6H5ClOS
Molecular Weight:
160.6213
MDL Number:
MFCD00005456
IUPAC Name:
2-thiophen-2-ylacetyl chloride
InChI:
InChI=1S/C6H5ClOS/c7-6(8)4-5-2-1-3-9-5/h1-3H,4H2
InChI Key:
AJYXPNIENRLELY-UHFFFAOYSA-N
SMILES:
ClC(=O)Cc1cccs1
EC Number:
254-290-0
UN Number:
1760
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.975g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.615g/mol
Monoisotopic Mass:
159.975g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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