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

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

CAS No.:
903130-38-1
Catalog Number:
AG01BE4M
Molecular Formula:
C5H2F3NOS
Molecular Weight:
181.1357
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Product Description
Catalog Number:
AG01BE4M
Chemical Name:
2-(trifluoromethyl)-1,3-thiazole-5-carbaldehyde
CAS Number:
903130-38-1
Molecular Formula:
C5H2F3NOS
Molecular Weight:
181.1357
MDL Number:
MFCD08448192
IUPAC Name:
2-(trifluoromethyl)-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C5H2F3NOS/c6-5(7,8)4-9-1-3(2-10)11-4/h1-2H
InChI Key:
SDTOCBWWASQPSN-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(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