Home Aldehydes 5-(Trifluoromethyl)-1,3-thiazole-2-carbaldehyde

5-(Trifluoromethyl)-1,3-thiazole-2-carbaldehyde

CAS No.:
1379174-19-2
Catalog Number:
AG0035U3
Molecular Formula:
C5H2F3NOS
Molecular Weight:
181.1357
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Product Description
Catalog Number:
AG0035U3
Chemical Name:
5-(Trifluoromethyl)-1,3-thiazole-2-carbaldehyde
CAS Number:
1379174-19-2
Molecular Formula:
C5H2F3NOS
Molecular Weight:
181.1357
MDL Number:
MFCD11846868
IUPAC Name:
5-(trifluoromethyl)-1,3-thiazole-2-carbaldehyde
InChI:
InChI=1S/C5H2F3NOS/c6-5(7,8)3-1-9-4(2-10)11-3/h1-2H
InChI Key:
GXVQGBUDNIUMEZ-UHFFFAOYSA-N
SMILES:
O=Cc1ncc(s1)C(F)(F)F
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.981g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.132g/mol
Monoisotopic Mass:
180.981g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties