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Z-Phe-Phe-OH

CAT: 0121-4000601.0005Size: 5 gDry Ice: NoHazardous: No
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CAT#:0121-4000601.0005Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
13122-91-3
Specifications
C-2420.0005
Sequence
Z-Phe-Phe-OH
Molecular Formula
C₂₆H₂₆N₂O₅
Molecular Weight
446.50
Shipping Conditions
Ambient Temperature
Storage Temperature
< -15°C

Chemical Information

N-((Phenylmethoxy)carbonyl)-L-phenylalanyl-L-phenylalanine
CAS Number13122-91-3
PubChem CID114619
IUPAC Name(2S)-3-phenyl-2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoic acid
Molecular FormulaC26H26N2O5
Molecular Weight446.5
XLogP3.4
Topological Polar Surface Area105
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count33
Formal Charge0
Complexity622
SMILES
C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)NC(=O)OCC3=CC=CC=C3
InChI
InChI=1S/C26H26N2O5/c29-24(27-23(25(30)31)17-20-12-6-2-7-13-20)22(16-19-10-4-1-5-11-19)28-26(32)33-18-21-14-8-3-9-15-21/h1-15,22-23H,16-18H2,(H,27,29)(H,28,32)(H,30,31)/t22-,23-/m0/s1
InChIKey
JNRHNGGTJOBXHL-GOTSBHOMSA-N
Chemical Structure
2D Structure
2D structure of N-((Phenylmethoxy)carbonyl)-L-phenylalanyl-L-phenylalanine
CAS: 13122-91-3
CID: 114619
Formula: C26H26N2O5
MW: 446.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight446.5
XLogP33.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass446.18417193
Monoisotopic Mass446.18417193
Topological Polar Surface Area105 Ų
Heavy Atom Count33
Formal Charge0
Complexity622
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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