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Fmoc-His(3-Bom)-OH

HCID 56777366
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Basic information

CAS
84891-19-0
Standard SMILES
O=C(N[C@@H](Cc1cncn1COCc1ccccc1)C(=O)O)OCC1c2ccccc2-c2ccccc21
InChIKey
CJBFCDKGOPEUOF-MHZLTWQESA-N
Molecular formula
C29H27N3O5
Average molar mass
497.5 g/mol
Monoisotopic mass
497.19507097

Overview

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Names & identifiers

Preferred name
Fmoc-His(3-Bom)-OH
IUPAC
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[3-(phenylmethoxymethyl)imidazol-4-yl]propanoic acid
English name
Fmoc-His(3-BOM)-OH
Molecular formula
C29H27N3O5
Molecular weight
497.54

Names & synonyms

Fmoc-His(3-Bom)-OH84891-19-0Fmoc-His(Bom)-OH(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(1-((benzyloxy)methyl)-1H-imidazol-5-yl)propanoic acidMFCD00077059(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[3-(phenylmethoxymethyl)imidazol-4-yl]propanoic acid(S)-3-[1-[(Benzyloxy)methyl]-5-imidazolyl]-2-(Fmoc-amino)propanoic AcidNa-(((9H-Fluoren-9-yl)methoxy)carbonyl)-Np-((benzyloxy)methyl)-L-histidineFmoc-L-His(p-Bom)-OHFmoc-His(-Bom)-OHn-alpha-fmoc-n(im)-benzyloxymethyl-l-histidineSCHEMBL5717685
Show more names
FMOC-HIS(P-BOM)-OHFMOC-HIS(PI-BOM)-OHFMOC-L-HIS(3-BOM)-OHFMOC-HISTIDINE(3-BOM)-OHnα-fmoc-π-bom-l-histidineFMOC-HIS(3-BOM)-OH USP/EP/BPFmoc-His(3-Bom)-OH≥ 99% (HPLC)
N-Fluorenylmethoxycarbonyl-N'-benzyloxymethyl-L-histidineSCHEMBL30196497DTXSID60718553n-alpha-(9-fluorenylmethoxycarbonyl)-n-pi-benzyloxymethyl-l-histidineAKOS027328020FD21697AS-49163SY239835

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
103 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
37
Formal charge
0
Complexity
738

Physicochemical properties

Boiling point
757.7 · 757.7±60.0 °C(Predicted)
Density
1.3 · 1.30±0.1 g/cm3(Predicted)
storage temp.
-20 °C · Sealed in dry,Store in freezer, under -20°C
pka
3.44 · 3.44±0.10(Predicted)
Appearance
White to off-white Solid
Safety Statements
22 · 22-24/25
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
3
safety_code
22-24/25

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes

Database identifiers

CAS
84891-19-0
PubChem CID
56777366
DTXSID
DTXSID60718553