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1184003-54-0 | 2-(thiophen-3-yl)-1,3-thiazole-4-carbaldehyde
CAS No: 1184003-54-0 Catalog No: AG019WXB MDL No:MFCD12818487
Product Description
Catalog Number:
AG019WXB
Chemical Name:
2-(thiophen-3-yl)-1,3-thiazole-4-carbaldehyde
CAS Number:
1184003-54-0
Molecular Formula:
C8H5NOS2
Molecular Weight:
195.2614
MDL Number:
MFCD12818487
IUPAC Name:
2-thiophen-3-yl-1,3-thiazole-4-carbaldehyde
InChI:
InChI=1S/C8H5NOS2/c10-3-7-5-12-8(9-7)6-1-2-11-4-6/h1-5H
InChI Key:
QXHCPMXMQIOHLG-UHFFFAOYSA-N
SMILES:
O=Cc1csc(n1)c1cscc1
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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