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195457-70-6,MFCD03424607
Catalog No.:AA003KID
195457-70-6 | 3'-(Trifluoromethyl)-[1,1'-biphenyl]-4-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$55.00
- +
5g
98%
in stock  
$195.00
- +
  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003KID
Chemical Name:
3'-(Trifluoromethyl)-[1,1'-biphenyl]-4-carboxylic acid
CAS Number:
195457-70-6
Molecular Formula:
C14H9F3O2
Molecular Weight:
266.2153
MDL Number:
MFCD03424607
IUPAC Name:
4-[3-(trifluoromethyl)phenyl]benzoic acid
InChI:
InChI=1S/C14H9F3O2/c15-14(16,17)12-3-1-2-11(8-12)9-4-6-10(7-5-9)13(18)19/h1-8H,(H,18,19)
InChI Key:
LFMPHDUPXVEMAB-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)c1cccc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.055g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
266.219g/mol
Monoisotopic Mass:
266.055g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

Synonyms
 
195457-70-6 
3'-(trifluoromethyl)-[1,1'-biphenyl]-4-carboxylic acid 
3'-(trifluoromethyl)[1,1'-biphenyl]-4-carboxylic acid 
PubChem10315 
AC1MD2XG 
ACMC-1CA4F 
AMTDA072 
SCHEMBL2344585 
CTK0H8126 
KS-00000CTA 
DTXSID80382235 
LFMPHDUPXVEMAB-UHFFFAOYSA-N 
3'-Trifluoromethylbiphenyl-4-carboxylic acid 
ZINC2574073 
ANW-23690 
BDBM50060999 
MFCD03424607 
SBB103006 
AKOS000124685 
CS-W003064 
DS-1732 
PS-7315 
RTR-009093 
4-[3-(trifluoromethyl)phenyl]benzoic Acid 
TRA0017232 
VZ25340 
NCGC00374149-01 
4-[3-(Trifluoromethyl)phenyl]benzoicAcid 
AJ-42188 
AK-79432 
BC223208 
BR-79432 
SC-49768 
SY019813 
3'-Trifluoromethyl-biphenyl-4-carboxylic acid 
3'-Trifluromethylbiphenyl-4-carboxylic acid 
AB0009198 
TR-009093 
4CH-000715 
AM20030271 
BB 0222375 
FT-0643828 
ST24028150 
3''-Trifluoromethyl-biphenyl-4-carboxylic acid 
A-3370 
4-(3-Trifluoromethylphenyl)benzoic acid 
T40042 
MFCD03424607 (97+%) 
J-513123 
3'-(trifluoromethyl)-1,1'-biphenyl-4-carboxylic acid 
I01-11597 
C14H9F3O2 
CID2782717 
3-TRIFLUOROMETHYLBIPHENYL-4-CARBOXYLIC ACID 
1156264-10-6 
CHEMBL321440 
3'-(trifluoromethyl)biphenyl-4-carboxylic acid 
[1,1'-Biphenyl]-4-carboxylicacid, 3'-(trifluoromethyl)- 
[1,1'-Biphenyl]-4-carboxylic acid, 3'-(trifluoromethyl)- 
Literature
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