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Fmoc-Phe (4-CN) -OH

CAT: 1410-M23785-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Fmoc-Phe (4-CN) -OH is an N-Fmoc protected phenylalanine derivative and potentially useful synthetic intermediate.
CAS Number
173963-93-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
412.44
Molecular Formula
C25H20N2O4
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Fmoc-Phe(4-CN)-OH
CAS Number173963-93-4
PubChem CID6957993
IUPAC Name(2S)-3-(4-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
Complexity671
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=C(C=C4)C#N)C(=O)O
InChI
InChI=1S/C25H20N2O4/c26-14-17-11-9-16(10-12-17)13-23(24(28)29)27-25(30)31-15-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-12,22-23H,13,15H2,(H,27,30)(H,28,29)/t23-/m0/s1
InChIKey
JOPKKUTWCGYCDA-QHCPKHFHSA-N
Chemical Structure
2D Structure
2D structure of Fmoc-Phe(4-CN)-OH
CAS: 173963-93-4
CID: 6957993
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
Complexity671
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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Alternative Products

CatalogName
GTR18919044Fmoc-Phe (4-CN) -OH
MBS5765178Fmoc-Phe(4-CN)-OH
A22884-5000Fmoc-Phe (4-CN) -OH 5g
A22884-25000Fmoc-Phe (4-CN) -OH 25g
A22884-10000Fmoc-Phe (4-CN) -OH 10g
5-03992Fmoc-D-Phe(4-CN)-OH
HY-W010957-01Fmoc-D-Phe (4-CN) -OH
A22884-1000Fmoc-Phe (4-CN) -OH 1000mg
A22884-500Fmoc-Phe (4-CN) -OH 500mg
A23289-100000Fmoc-D-Phe (4-CN) -OH 100g

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