L-Pentafluorophenylalanine

CAT: 0127-PC8360-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC8360-01Size:100 mg

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CAS Number

34702-59-5

Synonyms

(S) -2-Amino-3- (pentafluorophenyl) propanoic acid

MDL Number

MFCD01860881

Purity

95%

Smiles

N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(=O)O

Chemical Information

Pentafluorophenylalanine, L-

CAS Number	34702-59-5
PubChem CID	2761496
IUPAC Name	(2S)-2-amino-3-(2,3,4,5,6-pentafluorophenyl)propanoic acid
Molecular Formula	C9H6F5NO2
Molecular Weight	255.14
XLogP	-0.9
Topological Polar Surface Area	63.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	277

SMILES

C(C1=C(C(=C(C(=C1F)F)F)F)F)[C@@H](C(=O)O)N

InChI

InChI=1S/C9H6F5NO2/c10-4-2(1-3(15)9(16)17)5(11)7(13)8(14)6(4)12/h3H,1,15H2,(H,16,17)/t3-/m0/s1

InChIKey

YYTDJPUFAVPHQA-VKHMYHEASA-N

Chemical Structure

2D Structure

CAS: 34702-59-5

CID: 2761496

Formula: C9H6F5NO2

MW: 255.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	255.14
XLogP3	-0.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Exact Mass	255.03186924
Monoisotopic Mass	255.03186924
Topological Polar Surface Area	63.3 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	277
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC8361	D-Pentafluorophenylalanine
PC0348	D-Pentafluorophenylalanine, N-FMOC protected
OR1066054-01	L-Tyrosyl-L-arginyl-L-seryl-L-arginyl-L-lysyl-L-tyrosyl-L-seryl-L-seryl-L-tryptophyl-L-tyrosine
OR1066094	L-Histidyl-L-histidyl-L-alanyl-L-seryl-L-prolyl-L-arginyl-L-lysine
OR1066222-01	L-Tyrosyl-L-arginyl-L-seryl-L-arginyl-L-lysyl-L-tyrosyl-L-seryl-L-seryl-L-tryptophyl-L-tyrosine acetate
OR1054872-01	L-Phenylalanyl-L-cysteinyl-L-isoleucylglycyl-L-arginyl-L-leucine
OR1056899-01	L-Methionyl-L-arginyl-L-phenylalanyl-L-alanine
OR1056207-01	L-Cysteinyl-L-asparaginylglycyl-L-arginyl-L-cysteinylglycine
OR1057079-01	L-Alanyl-L-alanyl-L-alanyl-L-alanine
OR1065289	L-Arginylglycyl-L-tyrosyl-L-seryl-L-leucylglycine

Catalog	Name
450746-01	Fmoc-L-pentafluorophenylalanine
450575-01	Fmoc-D-pentafluorophenylalanine
CCP1053-01	A-L-A-L
453309-01	L-Glycyl-L-lysyl-L-leucyl-L-isoleucyl-L-tyrosyl-L-seryl-L-alanyl-L-seryl-L-phenylalanyl-L-leucyl-L-tyrosyl-L-seryl-L-glycyl-L-valyl-L-prolyl-L-seryl-L-arganine
453434-01	L-Seryl-L-threonyl-L-glycyl-L-isoleucyl-L-seryl-L-valyl-L-prolyl-L-glycyl-L-prolyl-L-methionyl-L-glycyl-L-prolyl-L-seryl-L-glycyl-L-prolyl-L-Arginine
JH918176	L-Arginine, L-valyl-L-seryl-L-arginyl-L-arginyl-L-arginyl-L-arginyl-L-arginyl-L-arginylglycylglycyl-L-arginyl-L-arginyl-L-arginyl-
453216-01	L-Arginyl-L-valyl-L-α-aspartyl-L-prolyl-L-valyl-L-asparaginyl-L-phenylalanyl-L-lysyl-L-leucyl-L-leucyl-L-seryl-L-histidine
453308-01	L-Glycyl-L-arginyl-L-phenylalanyl-L-isoleucyl-L-threonyl-L-seryl-L-alanyl-L-aspartyl-L-threonyl-L-lysine
918629-48-8	L-Alanyl-L-Cysteinyl-L-Seryl-L-Seryl-L-Seryl-L-Prolyl-L-Seryl-L-Lysyl-L-Histidyl-L-Cysteinylglycine
453464-01	L-Tryptophyl-L-arginyl-L-glutaminyl-L-alanyl-L-alanyl-L-phenylalanyl-L-valyl-L-α-aspartyl-L-seryl-L-tyrosine