N-alpha-tert-Butyloxycarbonyl-glutamic acid beta-fluorenylmethyl ester
Basic information
- CAS
133906-29-3- Standard SMILES
CC(C)(C)OC(=O)N[C@@H](CCC(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21- InChIKey
KSYVYHUPZNONJS-FQEVSTJZSA-N- Molecular formula
- C24H27NO6
- Average molar mass
- 425.5 g/mol
- Monoisotopic mass
- 425.18383758
Overview
structure given in first source
Names & identifiers
- Preferred name
- N-alpha-tert-Butyloxycarbonyl-glutamic acid beta-fluorenylmethyl ester
- IUPAC
- (4S)-5-(9H-fluoren-9-ylmethoxy)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid
- English name
- N-alpha-tert-butyloxycarbonyl-glutamic acid beta-fluorenylmethyl ester
- Molecular formula
- C24H27NO6
- Molecular weight
- 425.47
Names & synonyms
133906-29-3BG-beta-FmeN-alpha-tert-Butyloxycarbonyl-glutamic acid beta-fluorenylmethyl esterNalpha-Boc-glu-beta-fluorenylmethyl esterDTXSID60158415RefChem:162860DTXCID5080906boc-glu-ofmMFCD00151872(4S)-5-(9H-fluoren-9-ylmethoxy)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acidSCHEMBL7326541AKOS027251427
Show more names
Boc-L-Glu-OFmBoc-L-glutamic acid α-9-fluorenylmethyl esterL-Glutamic acid, N-[(1,1-dimethylethoxy)carbonyl]-, 1-(9H-fluoren-9-ylmethyl) ester(4S)-4-{[(tert-butoxy)carbonyl]amino}-5-[(9H-fluoren-9-yl)methoxy]-5-oxopentanoic acid
HY-35028(S)-5-((9H-Fluoren-9-yl)methoxy)-4-((tert-butoxycarbonyl)amino)-5-oxopentanoic acidL-Glutamic acid, N-((1,1-dimethylethoxy)carbonyl)-, 1-(9H-fluoren-9-ylmethyl) esterBoc-L-glutamic acid alpha-9-fluorenylmethyl esterN-alpha-tert-BuN-boc-l-glutamic acid 1-(9h-fluoren-9-ylmethyl) esterSCHEMBL29586109DS-9998
Database identifiers
- CAS
133906-29-3- PubChem CID
- 131685
- DTXSID
DTXSID60158415- Nikkaji
- J291.442E
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 635
Physicochemical properties
- Boiling point
- 638.1 · 638.1±55.0 °C(Predicted)
- Density
- 1.232 · 1.232±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 4.46 · 4.46±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312-H315-H319
- Precautionary statements
- 501 · P501-P270-P264-P280-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P302+P352+P312
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312-H315-H319
- Precautionary statements
- P501-P270-P264-P280-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P302+P352+P312
Chemistry & industry
Applications
UsesBoc-Glu-Ofm is used in solid-phase peptide synthesis and the synthesis of [AspB10,LysB28,ProB29]-ester insulin.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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