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Basic information
- CAS
229623-55-6- Standard SMILES
CC(C)(C)OC(=O)NCc1ccc(C#N)c(F)c1- InChIKey
RXPIQTLYLUDUNU-UHFFFAOYSA-N- Molecular formula
- C13H15FN2O2
- Average molar mass
- 250.273 g/mol
- Monoisotopic mass
- 250.11175594
Names & identifiers
- Preferred name
- TERT-BUTYL 4-CYANO-3-FLUOROBENZYLCARBAMATE
- IUPAC
- tert-Butyl [(4-cyano-3-fluorophenyl)methyl]carbamate
- English name
- tert-Butyl 4-cyano-3-fluorobenzylcarbamate
- Molecular formula
- C13H15FN2O2
- Molecular weight
- 250.27
Names & synonyms
tert-Butyl 4-cyano-3-fluorobenzylcarbamatetert-butyl N-[(4-cyano-3-fluorophenyl)methyl]carbamate(4-Cyano-3-fluoro-benzyl)-carbamic acid tert-butyl esterN-[(4-cyano-3-fluorophenyl)methyl]carbamic acid tert-butyl ester[(4-Cyano-3-Fluorophenyl)Methyl]-Carbamic Acid 1,1-Dimethylethyl EsterCarbamic acid, N-[(4-cyano-3-fluorophenyl)methyl]-, 1,1-dimethylethyl ester
Database identifiers
- CAS
229623-55-6- PubChem CID
- 10911925
- DTXSID
DTXSID20448142- ChEMBL
CHEMBL4927308
Properties
Physicochemical properties
- Boiling point
- 387.5 · 387.5±37.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- pka
- 11.62 · 11.62±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers2 total
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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