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Home > Aldehydes > 1096934-92-7
1096934-92-7 | 5-[4-chloro-2-(trifluoromethyl)phenyl]thiophene-2-carbaldehyde
CAS No: 1096934-92-7 Catalog No: AG01ABFS MDL No:MFCD11544055
Product Description
Catalog Number:
AG01ABFS
Chemical Name:
5-[4-chloro-2-(trifluoromethyl)phenyl]thiophene-2-carbaldehyde
CAS Number:
1096934-92-7
Molecular Formula:
C12H6ClF3OS
Molecular Weight:
290.6886
MDL Number:
MFCD11544055
IUPAC Name:
5-[4-chloro-2-(trifluoromethyl)phenyl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C12H6ClF3OS/c13-7-1-3-9(10(5-7)12(14,15)16)11-4-2-8(6-17)18-11/h1-6H
InChI Key:
WCXJCCMSVLLWRS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)c1ccc(cc1C(F)(F)F)Cl
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.978g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.684g/mol
Monoisotopic Mass:
289.978g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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