Home Fluorides 152152-19-7
152152-19-7,MFCD00083529
Catalog No.:AA003IBZ
152152-19-7 | 3,4,5-Trifluorocinnamic acid
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1g
in stock  
$144.00   $101.00
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5g
in stock  
$219.00   $153.00
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25g
95%
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$391.00   $274.00
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Technical Information
Catalog Number:
AA003IBZ
Chemical Name:
3,4,5-Trifluorocinnamic acid
CAS Number:
152152-19-7
Molecular Formula:
C9H5F3O2
Molecular Weight:
202.1300
MDL Number:
MFCD00083529
IUPAC Name:
(E)-3-(3,4,5-trifluorophenyl)prop-2-enoic acid
InChI:
InChI=1S/C9H5F3O2/c10-6-3-5(1-2-8(13)14)4-7(11)9(6)12/h1-4H,(H,13,14)/b2-1+
InChI Key:
PHIWFMZBVZFEQJ-OWOJBTEDSA-N
SMILES:
OC(=O)/C=C/c1cc(F)c(c(c1)F)F
Properties
Computed Properties
 
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
202.024g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.132g/mol
Monoisotopic Mass:
202.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Synonyms
 
3,4,5-Trifluorocinnamic acid 
152152-19-7 
SCHEMBL584606 
RARECHEM BK HW 0056 
PHIWFMZBVZFEQJ-OWOJBTEDSA-N 
ACT13054 
JRD-0643 
ZINC2575055 
ZX-AP003534 
PC8270 
SBB068773 
AKOS005255167 
3-(3,4,5-trifluoro-phenyl)-acrylic acid 
AKOS025310001 
AC-9775 
AS01922 
RTR-006268 
AJ-42318 
AB0020980 
TR-006268 
TRANS-3,4,5-TRIFLUOROCINNAMIC ACID 
ST24041127 
ST50827428 
(E)-3-(3,4,5-trifluorophenyl)acrylic acid 
V2085 
C-5639 
EN300-137065 
(E)-3-(3,4,5-trifluorophenyl)prop-2-enoic acid 
152T197 
J-008897 
S01-0188 
2-Propenoic acid, 3-(3,4,5-trifluorophenyl)-, (2E)- 
3,4,5-Trifluorocinnamic acid, 97% (predominantly trans) 
C9H5F3O2 
(2E)-3-(3,4,5-trifluorophenyl)prop-2-enoic acid 
CID5708779 
3-(3,4,5-trifluorophenyl)prop-2-enoic Acid 
TRANS-3,4,5-TRIFLUOROCINNAMICACID 
3,4,5-Trifluorocinnamic acid, 98% - 1G 1g 
MFCD00083529 
331245-88-6 
3,4,5-Trifluorocinnamicacid 
PubChem4351 
AC1NWNIQ 
Literature
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