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Fmoc-L-2-cyanophenylalanine

CAT: 0013-GTR19165963-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19165963-01Size:10 mg
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Description
Fmoc-L-2-cyanophenylalanine is a protected amino acid derivative essential for solid-phase peptide synthesis. Its unique cyano group enables site-specific bioconjugation and is utilized in constructing peptides and proteins for biochemical, in vitro, and cellular research applications.
CAS Number
401933-16-2
Product Name Alternative
FmocL2cyanophenylalanine, fmoc-L-2-cyanophenylalanine, fmoc L 2 cyanophenylalanine
Purity
97.86% (May vary between batches)
Solubility
DMSO:10 mg/mL (24.25 mM)
Smiles
OC (=O) [C@H] (Cc1ccccc1C#N) NC (=O) OCC1c2ccccc2-c2ccccc12
Molecular Formula
C25H20N2O4
Molecular Weight
412.44
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Fmoc-2-cyano-L-phenylalanine
CAS Number401933-16-2
PubChem CID2761476
IUPAC Name(2S)-3-(2-cyanophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
Molecular FormulaC25H20N2O4
Molecular Weight412.4
XLogP4.4
Topological Polar Surface Area99.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count31
Formal Charge0
Complexity679
SMILES
C1=CC=C(C(=C1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C#N
InChI
InChI=1S/C25H20N2O4/c26-14-17-8-2-1-7-16(17)13-23(24(28)29)27-25(30)31-15-22-20-11-5-3-9-18(20)19-10-4-6-12-21(19)22/h1-12,22-23H,13,15H2,(H,27,30)(H,28,29)/t23-/m0/s1
InChIKey
ACFGBBASKOIPEW-QHCPKHFHSA-N
Chemical Structure
2D Structure
2D structure of Fmoc-2-cyano-L-phenylalanine
CAS: 401933-16-2
CID: 2761476
Formula: C25H20N2O4
MW: 412.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight412.4
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass412.14230712
Monoisotopic Mass412.14230712
Topological Polar Surface Area99.4 Ų
Heavy Atom Count31
Formal Charge0
Complexity679
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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