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88511-88-0 | Ethanone, 2-hydroxy-1-(2-thienyl)-
CAS No: 88511-88-0 Catalog No: AG00489J MDL No:MFCD16165846
Product Description
Catalog Number:
AG00489J
Chemical Name:
Ethanone, 2-hydroxy-1-(2-thienyl)-
CAS Number:
88511-88-0
Molecular Formula:
C6H6O2S
Molecular Weight:
142.1756
MDL Number:
MFCD16165846
IUPAC Name:
2-hydroxy-1-thiophen-2-ylethanone
InChI:
InChI=1S/C6H6O2S/c7-4-5(8)6-2-1-3-9-6/h1-3,7H,4H2
InChI Key:
RWYQCSIKKZSICV-UHFFFAOYSA-N
SMILES:
OCC(=O)c1cccs1
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.009g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.172g/mol
Monoisotopic Mass:
142.009g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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