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Fmoc-D-ß-Homophenylalanine

CAT: 0127-OR1034384-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1034384-01Size:500 mg
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CAS Number
209252-16-4
Purity
97%
Smiles
C1=CC=C(C=C1)C[C@H](CC(=O)O)N=C(O)OCC2C3=CC=CC=C3C4=CC=CC=C42

Chemical Information

(3R)-3-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)-4-phenylbutanoic acid
CAS Number209252-16-4
PubChem CID7014919
IUPAC Name(3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-phenylbutanoic acid
Molecular FormulaC25H23NO4
Molecular Weight401.5
XLogP4.6
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity566
SMILES
C1=CC=C(C=C1)C[C@H](CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C25H23NO4/c27-24(28)15-18(14-17-8-2-1-3-9-17)26-25(29)30-16-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,18,23H,14-16H2,(H,26,29)(H,27,28)/t18-/m1/s1
InChIKey
DQNUGHJJKNFCND-GOSISDBHSA-N
Chemical Structure
2D Structure
2D structure of (3R)-3-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)-4-phenylbutanoic acid
CAS: 209252-16-4
CID: 7014919
Formula: C25H23NO4
MW: 401.5
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight401.5
XLogP34.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass401.16270821
Monoisotopic Mass401.16270821
Topological Polar Surface Area75.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity566
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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