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2091647-00-4 | 3-(1,3-thiazol-5-yl)thiophene-2-carbaldehyde
CAS No: 2091647-00-4 Catalog No: AG01BJLZ MDL No:MFCD30752996
Product Description
Catalog Number:
AG01BJLZ
Chemical Name:
3-(1,3-thiazol-5-yl)thiophene-2-carbaldehyde
CAS Number:
2091647-00-4
Molecular Formula:
C8H5NOS2
Molecular Weight:
195.2614
MDL Number:
MFCD30752996
IUPAC Name:
3-(1,3-thiazol-5-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C8H5NOS2/c10-4-8-6(1-2-11-8)7-3-9-5-12-7/h1-5H
InChI Key:
VHIRSBWRGDHWAS-UHFFFAOYSA-N
SMILES:
O=Cc1sccc1c1cncs1
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.981g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.254g/mol
Monoisotopic Mass:
194.981g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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