Basic information
- CAS
172965-67-2- Standard SMILES
CCN(CCC(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21- InChIKey
AREQXKGLQHHFSL-UHFFFAOYSA-N- Molecular formula
- C20H21NO4
- Average molar mass
- 339.4 g/mol
- Monoisotopic mass
- 339.14705815
Names & identifiers
- Preferred name
- 3-(ethyl((((9H-fluoren-9-yl)methoxy)carbonyl))amino)propanoic acid
- IUPAC
- 3-[ethyl(9H-fluoren-9-ylmethoxycarbonyl)amino]propanoic acid
- English name
- 3-[ethyl({[(9H-fluoren-9-yl)methoxy]carbonyl})amino]propanoic acid
- Molecular formula
- C20H21NO4
- Molecular weight
- 339.39
Names & synonyms
172965-67-23-[ethyl({[(9H-fluoren-9-yl)methoxy]carbonyl})amino]propanoic acid3-(ethyl((((9H-fluoren-9-yl)methoxy)carbonyl))amino)propanoic acidRefChem:495163977-335-23-(ethyl[(9h-fluoren-9-ylmethoxy)carbonyl]amino)propanoic acidMFCD01861328N-Fmoc-3-(ethylamino)propanoic acid3-[ethyl(9H-fluoren-9-ylmethoxycarbonyl)amino]propanoic acidFmoc-beta-EtAla-OHSCHEMBL78537083-(EthylFmocamino)propanoic acid
Show more names
N-β-(9-Fluorenylmethoxycarbonyl)-N-β-ethyl-β-alanineβ-Alanine, N-ethyl-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
3-[Fmoc(ethyl)amino]propanoic AcidAKOS012614378SY460355CS-0235352EN300-1556279F6532343-(ethyl[(9h-fluoren-9-ylmethoxy)carbonyl]amino)propanoicacid3-((((9H-Fluoren-9-yl)methoxy)carbonyl)(ethyl)amino)propanoic acid
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 458
Physicochemical properties
- Boiling point
- 533.8 · 533.8±29.0 °C(Predicted)
- Density
- 1.239 · 1.239±0.06 g/cm3(Predicted)
- pka
- 4.41 · 4.41±0.10(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers2 total
上海吉尔多肽有限公司+86-21-61263310 13764994101 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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