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Fmoc-Homophe-OH

CAT: 0121-4011602.0005Size: 5 gDry Ice: NoHazardous: No
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CAT#:0121-4011602.0005Size:5 g
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CAS Number
132684-59-4
Specifications
B-1535.0005
Synonyms
(S) -2- (Fmoc-amino) -4-phenyl-butyric acid NPC-14686
Sequence
Fmoc-Homophe-OH
Molecular Formula
C₂₅H₂₃NO₄
Molecular Weight
401.46
Shipping Conditions
Ambient Temperature
Storage Temperature
Room temperature

Chemical Information

(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-phenylbutanoic acid
CAS Number132684-59-4
PubChem CID2761467
IUPAC Name(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-phenylbutanoic acid
Molecular FormulaC25H23NO4
Molecular Weight401.5
XLogP5
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)CC[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C25H23NO4/c27-24(28)23(15-14-17-8-2-1-3-9-17)26-25(29)30-16-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h1-13,22-23H,14-16H2,(H,26,29)(H,27,28)/t23-/m0/s1
InChIKey
CIHPCIUGLIZADU-QHCPKHFHSA-N
Chemical Structure
2D Structure
2D structure of (2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-phenylbutanoic acid
CAS: 132684-59-4
CID: 2761467
Formula: C25H23NO4
MW: 401.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight401.5
XLogP35
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