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Home > Aldehydes > 2091845-36-0
2091845-36-0 | 3-(3-methyl-1,2-thiazol-5-yl)thiophene-2-carbaldehyde
CAS No: 2091845-36-0 Catalog No: AG01C71D MDL No:MFCD31433651
Product Description
Catalog Number:
AG01C71D
Chemical Name:
3-(3-methyl-1,2-thiazol-5-yl)thiophene-2-carbaldehyde
CAS Number:
2091845-36-0
Molecular Formula:
C9H7NOS2
Molecular Weight:
209.2880
MDL Number:
MFCD31433651
IUPAC Name:
3-(3-methyl-1,2-thiazol-5-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C9H7NOS2/c1-6-4-8(13-10-6)7-2-3-12-9(7)5-11/h2-5H,1H3
InChI Key:
QUNTUOVPVFGRAE-UHFFFAOYSA-N
SMILES:
O=Cc1sccc1c1snc(c1)C
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.997g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.281g/mol
Monoisotopic Mass:
208.997g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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