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Home > Aldehydes > 177194-34-2
177194-34-2 | 2-Thiophenecarboxaldehyde, 5-(methylsulfonyl)-
CAS No: 177194-34-2 Catalog No: AG00254U MDL No:MFCD16140368
Product Description
Catalog Number:
AG00254U
Chemical Name:
2-Thiophenecarboxaldehyde, 5-(methylsulfonyl)-
CAS Number:
177194-34-2
Molecular Formula:
C6H6O3S2
Molecular Weight:
190.2400
MDL Number:
MFCD16140368
IUPAC Name:
5-methylsulfonylthiophene-2-carbaldehyde
InChI:
InChI=1S/C6H6O3S2/c1-11(8,9)6-3-2-5(4-7)10-6/h2-4H,1H3
InChI Key:
HIQYRHNJVSDOTH-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)S(=O)(=O)C
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.976g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.231g/mol
Monoisotopic Mass:
189.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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