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Home > Aldehydes > 198205-95-7
198205-95-7 | [1,1'-Biphenyl]-4-carboxaldehyde, 2'-(trifluoromethyl)-
CAS No: 198205-95-7 Catalog No: AG002BCS MDL No:MFCD01631916
Product Description
Catalog Number:
AG002BCS
Chemical Name:
[1,1'-Biphenyl]-4-carboxaldehyde, 2'-(trifluoromethyl)-
CAS Number:
198205-95-7
Molecular Formula:
C14H9F3O
Molecular Weight:
250.2159
MDL Number:
MFCD01631916
IUPAC Name:
4-[2-(trifluoromethyl)phenyl]benzaldehyde
InChI:
InChI=1S/C14H9F3O/c15-14(16,17)13-4-2-1-3-12(13)11-7-5-10(9-18)6-8-11/h1-9H
InChI Key:
SDDRLRQYSYHJED-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ccccc1C(F)(F)F
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.22g/mol
Monoisotopic Mass:
250.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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