Benzyl (1-cyano-1-methylethyl)carbamate supplier

Name
BENZYL [1-CYANO-1-METHYLETHYL]CARBAMATE
EINECS
CAS No. 100134-82-5
Article Data14
CAS DataBase
Density 1.125 g/cm³
Solubility 70g/L
Melting Point 97 °C
Formula C₁₂H₁₄N₂O₂
Boiling Point 381.613 °C at 760 mmHg
Molecular Weight 218.255
Flash Point 184.593 °C
Transport Information
Appearance Colourless solid
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Carbamicacid, (1-cyano-1-methylethyl)-, benzyl ester (6CI);Carbamic acid,(1-cyano-1-methylethyl)-, phenylmethyl ester (9CI);
PSA 62.12000
LogP 2.60588

Benzyl (1-cyano-1-methylethyl)carbamate Chemical Properties

Product Name: Carbamicacid, N-(1-cyano-1-methylethyl)-, phenylmethyl ester (CAS NO.100134-82-5)

Molecular Formula: C₁₂H₁₄N₂O₂
Molecular Weight: 218.2518g/mol
Mol File: 100134-82-5.mol
Boiling point: 381.6 °C at 760 mmHg
Flash Point: 184.6 °C
Density: 1.124 g/cm³
Index of Refraction: 1.526
Molar Refractivity: 59.58 cm³
Molar Volume: 194 cm³
Surface Tension: 43.7 dyne/cm
Enthalpy of Vaporization: 62.99 kJ/mol
Vapour Pressure: 5.01E-06 mmHg at 25°C
XLogP3-AA: 1.8
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of Carbamicacid, N-(1-cyano-1-methylethyl)-, phenylmethyl ester (CAS NO.100134-82-5):
IUPAC Name: benzyl N-(2-cyanopropan-2-yl)carbamate
Canonical SMILES: CC(C)(C#N)NC(=O)OCC1=CC=CC=C1
InChI: InChI=1S/C12H14N2O2/c1-12(2,9-13)14-11(15)16-8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,14,15)
InChIKey: DJQKBMUYZUEUBU-UHFFFAOYSA-N

Benzyl (1-cyano-1-methylethyl)carbamate Specification

Carbamicacid, N-(1-cyano-1-methylethyl)-, phenylmethyl ester , its CAS NO. is 100134-82-5, the synonyms are Benzyl (1-cyano-1-methylethyl)carbamate ; Raltegravir I .

Product Name

BENZYL [1-CYANO-1-METHYLETHYL]CARBAMATE

Benzyl (1-cyano-1-methylethyl)carbamate Chemical Properties

Benzyl (1-cyano-1-methylethyl)carbamate Specification

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