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Fmoc-Orn (Boc) -OH

CAT: 0121-4004449.0025Size: 25 gDry Ice: NoHazardous: No
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CAT#:0121-4004449.0025Size:25 g
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CAS Number
109425-55-0
Specifications
B-1090.0025
Sequence
Fmoc-Orn (Boc) -OH
Molecular Formula
C₂₅H₃₀N₂O₆
Molecular Weight
454.52
Shipping Conditions
Ambient Temperature
Storage Temperature
Room temperature

Chemical Information

(2S)-5-(((tert-butoxy)carbonyl)amino)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)pentanoic acid
CAS Number109425-55-0
PubChem CID2756114
IUPAC Name(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
Molecular FormulaC25H30N2O6
Molecular Weight454.5
XLogP4.1
Topological Polar Surface Area114
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count33
Formal Charge0
Complexity669
SMILES
CC(C)(C)OC(=O)NCCC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C25H30N2O6/c1-25(2,3)33-23(30)26-14-8-13-21(22(28)29)27-24(31)32-15-20-18-11-6-4-9-16(18)17-10-5-7-12-19(17)20/h4-7,9-12,20-21H,8,13-15H2,1-3H3,(H,26,30)(H,27,31)(H,28,29)/t21-/m0/s1
InChIKey
JOOIZTMAHNLNHE-NRFANRHFSA-N
Chemical Structure
2D Structure
2D structure of (2S)-5-(((tert-butoxy)carbonyl)amino)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)pentanoic acid
CAS: 109425-55-0
CID: 2756114
Formula: C25H30N2O6
MW: 454.5
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight454.5
XLogP34.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass454.21038668
Monoisotopic Mass454.21038668
Topological Polar Surface Area114 Ų
Heavy Atom Count33
Formal Charge0
Complexity669
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