Home Fluorides 17463-43-3
17463-43-3,MFCD00004263
Catalog No.:AA003I90
17463-43-3 | 3,3,3-Trifluoro-dl-alanine
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100mg
98%
1 week  
$115.00   $80.00
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250mg
98%
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$177.00   $124.00
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1g
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$392.00   $274.00
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5g
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  • Technical Information
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  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003I90
Chemical Name:
3,3,3-Trifluoro-dl-alanine
CAS Number:
17463-43-3
Molecular Formula:
C3H4F3NO2
Molecular Weight:
143.0646
MDL Number:
MFCD00004263
IUPAC Name:
2-amino-3,3,3-trifluoropropanoic acid
InChI:
InChI=1S/C3H4F3NO2/c4-3(5,6)1(7)2(8)9/h1H,7H2,(H,8,9)
InChI Key:
HMJQKIDUCWWIBW-UHFFFAOYSA-N
SMILES:
NC(C(F)(F)F)C(=O)O
EC Number:
241-478-2
Properties
Computed Properties
 
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.019g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
143.065g/mol
Monoisotopic Mass:
143.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3  

Synonyms
 
3,3,3-trifluoroalanine 
3,3,3-Trifluoro-DL-alanine 
TRIFLUOROALANINE 
(R)-2-Amino-3,3,3-trifluoropropanoic acid 
ACMC-20cjek 
ACMC-1CUDZ 
AC1MC28H 
dl-3,3,3-trifluoroalanine 
Alanine,3,3,3-trifluoro- 
SCHEMBL202704 
CTK4D5048 
ANW-54018 
17463-43-3 
BBL101147 
CT-036 
SBB086268 
STL554943 
3,3,3-Trifluoro-DL-alanine, 98% 
AKOS005257592 
AKOS032963160 
FS-6311 
MCULE-4711987697 
RP20811 
2-amino-3,3,3-trifluoropropanoic acid 
VZ25372 
SC-33448 
AB0019848 
DB-043983 
TC-064436 
FT-0625397 
ST24027705 
V0377 
X-4303 
463T433 
3,3,3-Trifluoroalanine 
I14-39856 
L-Alanine, 3,3,3-trifluoro- 
DL-Alanine, 3,3,3-trifluoro- 
C3-H4-F3-N-O2 
EINECS 241-478-2 
2-amino-3,3,3-trifluoropropanoicacid 
ACN-055124 
ACN-055126 
CB10017 
CID2734920 
C3H4F3NO2 
(S)-2-amino-3,3,3-trifluoropropanoic acid 
(2R)-2-amino-3,3,3-trifluoropropanoic acid 
127127-25-7 
129939-36-2 
10065-69-7 
FLA 
2-Amino-3,3,3-trifluoropropionic acid 
MFCD00004263 
DL-3,3,3-Trifluoro-2-alanine 
HMJQKIDUCWWIBW-UHFFFAOYSA-N 
Literature

Title: Low energy (0-10 eV) electron driven reactions in the halogenated organic acids CCl3COOH, CClF2COOH, and CF3CHNH2COOH (trifluoroalanine).

Journal: The Journal of chemical physics 20110928

Title: A novel route to dipeptides via noncondensation of amino acids: 2-aminoperfluoropropene as a synthon for trifluoroalanine dipeptides.

Journal: Organic letters 20060302

Title: Identification and role of ionizing functional groups at the active center of Rhodotorula gracilis D-amino acid oxidase.

Journal: FEBS letters 20011102

Title: Identification of the active-site residue of gamma-cystathionase labeled by the suicide inactivator beta, beta, beta-trifluoroalanine.

Journal: Biochemistry 19820803

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