(2S)-3-(carbamoylamino)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)propanoic acid
Basic information
- CAS
1192601-91-4- Standard SMILES
NC(=O)NC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O- InChIKey
XSICSLZBMDMQRC-INIZCTEOSA-N- Molecular formula
- C19H19N3O5
- Average molar mass
- 369.4 g/mol
- Monoisotopic mass
- 369.13247072
Names & identifiers
- Preferred name
- (2S)-3-(carbamoylamino)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)propanoic acid
- IUPAC
- (2S)-3-(carbamoylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
- English name
- (2S)-3-(carbamoylamino)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid
- Molecular formula
- C19H19N3O5
- Molecular weight
- 369.37
Names & synonyms
1192601-91-4(2s)-3-(Carbamoylamino)-2-({[(9h-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid(2S)-3-(carbamoylamino)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)propanoic acidRefChem:398555862-723-5Fmoc-Alb-OH(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-ureidopropanoic acidFmoc-L-AlbizziineMFCD026824283-[(Aminocarbonyl)amino]-N-Fmoc-L-alanineFmoc-Dap(CONH2)-OHN-alpha-(9-Fluorenylmethoxycarbonyl)-L-albizziine
Show more names
Fmoc-L-Alb-OHN-α-(9-Fluorenylmethoxycarbonyl)-L-albizziineL-Alanine, 3-[(aminocarbonyl)amino]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
SCHEMBL18796084SCHEMBL30468234AS-89324SY382371(S)-2-(Fmoc-amino)-3-ureidopropanoic AcidCS-0232105F94058EN300-12630351
Database identifiers
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 548
Physicochemical properties
- Boiling point
- 647.6 · 647.6±55.0 °C(Predicted)
- Density
- 1.373 · 1.373±0.06 g/cm3(Predicted)
- pka
- 3.52 · 3.52±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H315-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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