9-Fluorenylmethyl carbamate
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Basic information
- CAS
84418-43-9- Standard SMILES
NC(=O)OCC1c2ccccc2-c2ccccc21- InChIKey
ZZOKVYOCRSMTSS-UHFFFAOYSA-N- Molecular formula
- C15H13NO2
- Average molar mass
- 239.27 g/mol
- Monoisotopic mass
- 239.09462866
Overview
See also: 9-Fluorenyl-methyl-carbamate (annotation moved to).
Names & identifiers
- Preferred name
- 9-Fluorenylmethyl carbamate
- IUPAC
- 9H-fluoren-9-ylmethyl carbamate
- English name
- 9-Fluorenylmethyl carbamate
- Molecular formula
- C15H13NO2
- Molecular weight
- 239.27
Names & synonyms
9-Fluorenylmethyl carbamateDTXSID00352990RefChem:1074974DTXCID4030405484418-43-9Fmoc-NH29H-fluoren-9-ylmethyl carbamateFmoc-amideMFCD00237376Fmoc amine(9h-fluoren-9-yl)methyl carbamateFMOC-amine
Show more names
9-Fluorenylcarbamate9-Fluorenylmethyl ca9-Fluorenemethane ResinFluorenylMethyl carbaMat9-FluorenylmethylecarbamateFluorenemethoxycarbonylamide
N-(9-Fluorenylmethoxycarbonyl)amide9H-Fluorene-9-methanol, 9-carbamateSCHEMBL113270SCHEMBL2192202Carbamic Acid 9-Fluorenylmethyl EsterSY019088M028629-Fluorenylmethylcarbamate
Database identifiers
- CAS
84418-43-9- PubChem CID
- 736301
- DTXSID
DTXSID00352990- Nikkaji
- J1.444.583H
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 296
Physicochemical properties
- Melting point
- 201 · 201-204 °C
- Boiling point
- 459.7 · 459.7±14.0 °C(Predicted)
- Density
- 1.239 · 1.239±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- 15 mg/mL, · dioxane: 15 mg/mL, clear, colorless
- pka
- 13.06 · 13.06±0.50(Predicted)
- form
- Liquid
- color
- Clear colorless to yellow
- BRN
- 4188192 · 4188192
- Major Application
- peptide synthesis
- InChI
- InChI=1S/C15H13NO2/c16-15(17)18-9-14-12-7-3-1-5-10(12)11-6-2-4-8-13(11)14/h1-8,14H,9H2,(H2,16,17)
- InChIKey
- ZZOKVYOCRSMTSS-UHFFFAOYSA-N
- SMILES
- C1(COC(=O)N)C2C=CC=CC=2C2C=CC=CC1=2
- CAS DataBase Reference
- 84418 · 84418-43-9(CAS DataBase Reference)
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
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 29242990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 22-24/25-36/37/39-27-26
- Storage Class
- 13 - Non Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
UsesReagent for the introduction of the Fmoc-group
Upstream & downstream products
Downstream products
Suppliers
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Related reactions
13 records
Compound notes
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