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Boc-Trp (Boc) -OH

CAT: 0024-sc-300295ASize: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-300295ASize:25 g
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CAS Number
144599-95-1

Chemical Information

Boc-Trp(Boc)-OH
CAS Number144599-95-1
PubChem CID7020330
IUPAC Name(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]propanoic acid
Molecular FormulaC21H28N2O6
Molecular Weight404.5
XLogP3.9
Topological Polar Surface Area107
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count29
Formal Charge0
Complexity622
SMILES
CC(C)(C)OC(=O)N[C@@H](CC1=CN(C2=CC=CC=C21)C(=O)OC(C)(C)C)C(=O)O
InChI
InChI=1S/C21H28N2O6/c1-20(2,3)28-18(26)22-15(17(24)25)11-13-12-23(19(27)29-21(4,5)6)16-10-8-7-9-14(13)16/h7-10,12,15H,11H2,1-6H3,(H,22,26)(H,24,25)/t15-/m0/s1
InChIKey
FATGZMFSCKUQGO-HNNXBMFYSA-N
Chemical Structure
2D Structure
2D structure of Boc-Trp(Boc)-OH
CAS: 144599-95-1
CID: 7020330
Formula: C21H28N2O6
MW: 404.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight404.5
XLogP33.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass404.19473662
Monoisotopic Mass404.19473662
Topological Polar Surface Area107 Ų
Heavy Atom Count29
Formal Charge0
Complexity622
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
RM-F131631-01Fmoc-Trp (Boc) -Trp (Boc) -Oh
A-4550.0025Boc-Trp(Boc)-OH
RM-T162040-01Boc-Trp (Boc) -Oh
2057-01Boc-Trp
5-06144Boc-D-Trp(Boc)-OH
RM-F131660-01Fmoc-D-Trp (Boc) -D-Trp (Boc) -OH
A-2360.0500Boc-Trp-OH
A-1625.0500Boc-Trp(For)-OH
A-3410.0025Boc-Trp(For)-OSu
2139-01Boc-Trp (Hoc)

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