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89055-44-7 | 2-Thiophenecarboxaldehyde, 4,5-dihydro-3-methyl-
CAS No: 89055-44-7 Catalog No: AG0087SJ MDL No:
Product Description
Catalog Number:
AG0087SJ
Chemical Name:
2-Thiophenecarboxaldehyde, 4,5-dihydro-3-methyl-
CAS Number:
89055-44-7
Molecular Formula:
C6H8OS
Molecular Weight:
128.1921
IUPAC Name:
4-methyl-2,3-dihydrothiophene-5-carbaldehyde
InChI:
InChI=1S/C6H8OS/c1-5-2-3-8-6(5)4-7/h4H,2-3H2,1H3
InChI Key:
IIDIKVVRJNPPOT-UHFFFAOYSA-N
SMILES:
O=CC1=C(C)CCS1
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.03g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.189g/mol
Monoisotopic Mass:
128.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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