Basic information
- Name:
1-Pyrrolidinecarboxylicacid, 3-cyano-4-oxo-, 1,1-dimethylethyl ester
- Superlist Name:
- 1-Boc-3-cyano-4-oxopyrrolidine
- CAS No.:
175463-32-8
- Molecular Structure:
- Formula:
- C10H14N2O3
- Molecular Weight:
- 210.23
- Synonyms:
- 1,1-Dimethylethyl3-cyano-4-oxo-1-pyrrolidinecarboxylate;1-tert-Butoxycarbonyl-4-oxopyrrolidine-3-carbonitrile;tert-Butyl 3-cyano-4-oxo-1-pyrrolidine carboxylate;
- Density:
- 1.18 g/cm3
- Melting Point:
- 160-167 °C
- Boiling Point:
- 360.7 °C at 760 mmHg
- Flash Point:
- 172 °C
- Transport Information:
- UN 3439
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Chemistry
Molecular Structure of 1-Boc-3-cyano-4-oxopyrrolidine (CAS NO.175463-32-8):
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IUPAC Name: tert-butyl 3-cyano-4-oxopyrrolidine-1-carboxylate
Empirical Formula: C10H14N2O3
Molecular Weight: 210.2298
H bond acceptors: 5
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 70.4 Å2
Index of Refraction: 1.499
Molar Refractivity: 52.08 cm3
Molar Volume: 177.1 cm3
Surface Tension: 46 dyne/cm
Density: 1.18 g/cm3
Flash Point: 172 °C
Enthalpy of Vaporization: 60.65 kJ/mol
Boiling Point: 360.7 °C at 760 mmHg
Vapour Pressure: 2.17E-05 mmHg at 25°C
Melting point: 91 °C
Product Categories: pharmacetical; Pyrrole&Pyrrolidine&Pyrroline
Safety Profile
RIDADR: UN3439
HazardClass: 6.1
PackingGroup: III
Specification
1-Boc-3-cyano-4-oxopyrrolidine , with CAS number of 175463-32-8, can be called Tert-butyl-3-cyano-4-oxopyrrolidine-1-carboxylate ; n-boc-3-cyano-4-pyrrolidinone ; 3-cyano-4-oxo-pyrrolidine-1-carboxylic acid tert-butyl ester ; 4-cyano-1-n-boc pyrrolidin-3-one ; 1-boc-3-cyano-4-oxopyrrolidine ; 1-n-boc-3-cyano-pyrrolid-4-one ; 1-n-boc-3-cyano-pyrrolidinone-4 ; 1-n-boc-3-cyano-pyrrolidone-4 .
