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887987-48-6 | 5-(3-(TRIFLUOROMETHOXY)PHENYL)THIOPHENE-2-CARBALDEHYDE
CAS No: 887987-48-6 Catalog No: AG01BW9L MDL No:MFCD06410195
Product Description
Catalog Number:
AG01BW9L
Chemical Name:
5-(3-(TRIFLUOROMETHOXY)PHENYL)THIOPHENE-2-CARBALDEHYDE
CAS Number:
887987-48-6
Molecular Formula:
C12H7F3O2S
Molecular Weight:
272.2430
MDL Number:
MFCD06410195
IUPAC Name:
5-[3-(trifluoromethoxy)phenyl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C12H7F3O2S/c13-12(14,15)17-9-3-1-2-8(6-9)11-5-4-10(7-16)18-11/h1-7H
InChI Key:
PEYVORVOTSTWGE-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)c1cccc(c1)OC(F)(F)F
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.012g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.241g/mol
Monoisotopic Mass:
272.012g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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