Fmoc-His (Boc) -OPfp

CAT: 0121-4015229.0025Size: 25 gDry Ice: NoHazardous: No

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CAT#:0121-4015229.0025Size:25 g

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CAS Number

109053-20-5

Specifications

B-2000.0025

Sequence

Fmoc-His (Boc) -OPfp

Molecular Formula

C₃₂H₂₆F₅N₃O₆

Molecular Weight

643.57

Shipping Conditions

Ambient Temperature

Storage Temperature

< -15°C

Chemical Information

Fmoc-His(Boc)-OPfp

CAS Number	109053-20-5
PubChem CID	13996187
IUPAC Name	tert-butyl 4-[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-oxo-3-(2,3,4,5,6-pentafluorophenoxy)propyl]imidazole-1-carboxylate
Molecular Formula	C32H26F5N3O6
Molecular Weight	643.6
XLogP	6.4
Topological Polar Surface Area	109
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	11
Heavy Atom Count	46
Formal Charge	0
Complexity	1060

SMILES

CC(C)(C)OC(=O)N1C=C(N=C1)CC(C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C32H26F5N3O6/c1-32(2,3)46-31(43)40-13-16(38-15-40)12-22(29(41)45-28-26(36)24(34)23(33)25(35)27(28)37)39-30(42)44-14-21-19-10-6-4-8-17(19)18-9-5-7-11-20(18)21/h4-11,13,15,21-22H,12,14H2,1-3H3,(H,39,42)

InChIKey

LRGNPXMUMGUURS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 109053-20-5

CID: 13996187

Formula: C32H26F5N3O6

MW: 643.6

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	643.6
XLogP3	6.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	11
Exact Mass	643.17417637
Monoisotopic Mass	643.17417637
Topological Polar Surface Area	109 Å²
Heavy Atom Count	46
Formal Charge	0
Complexity	1060
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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FF111302-01	Fmoc-His (Boc) -OPfp
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FF111288-01	Fmoc-His (Fmoc) -OPfp
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5-02132	Fmoc-OPfp
PC1003988-01	Fmoc-Lys (Fmoc) -Opfp
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Fmoc-His (Boc) -OPfp

Chemical Information

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