1-Boc-4-cyanopiperidine supplier

Name
1-Boc-4-cyanopiperidine
EINECS
CAS No. 91419-52-2
Article Data48
CAS DataBase
Density 1.07 g/cm³
Solubility
Melting Point 60-62 °C
Formula C₁₁H₁₈N₂O₂
Boiling Point 325.3 °C at 760 mmHg
Molecular Weight 210.276
Flash Point 150.5 °C
Transport Information
Appearance yellowish oil
Safety 36-36/37/39
Risk Codes 20/21/22
Molecular Structure
Hazard Symbols 20/21/22:;
Synonyms 1,1-Dimethylethyl4-cyano-1-piperidinecarboxylate;1-(tert-Butoxycarbonyl)-4-cyanopiperidine;1-(tert-Butoxycarbonyl)piperidine-4-carbonitrile;4-Cyano-1-piperidinecarboxylic acid 1,1-dimethylethyl ester;4-Cyanopiperidine-1-carboxylic acid tert-butyl ester;N-tert-Butoxycarbonyl-4-cyanopiperidine;N-tert-Butoxycarbonyl-4-piperidinecarbonitrile;tert-Butyl 4-cyanopiperidine-1-carboxylate;
PSA 53.33000
LogP 2.09498

1-Boc-4-cyanopiperidine Chemical Properties

The molecular structure of 1-Boc-4-cyanopiperidine (CAS NO.91419-52-2):

IUPAC Name: tert-Butyl 4-cyanopiperidine-1-carboxylate
Molecular Weight: 210.27282 g/mol
Molecular Formula: C₁₁H₁₈N₂O₂
Density: 1.07 g/cm³
Melting Point: 60-62 °C
Boiling Point: 325.3 °C at 760 mmHg
Flash Point: 150.5 °C
Index of Refraction: 1.487
Molar Refractivity: 56.59 cm³
Molar Volume: 196.4 cm³
Surface Tension: 40.7 dyne/cm
Enthalpy of Vaporization: 56.74 kJ/mol
Vapour Pressure: 0.000232 mmHg at 25 °C
XLogP3-AA: 1.3
H-Bond Acceptor: 3
Rotatable Bond Count: 2
Exact Mass: 210.136828
MonoIsotopic Mass: 210.136828
Topological Polar Surface Area: 53.3
Heavy Atom Count: 15
Canonical SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C#N
InChI: InChI=1S/C11H18N2O2/c1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13/h9H,4-7H2,1-3H3
InChIKey: UQADQTBQNVARAP-UHFFFAOYSA-N
Product Categories: Boron, Nitrile, Thio,& TM-Cpds; Heterocycles; pharmacetical; Pyrans, Piperidines &Piperazines; Piperidine; Piperazine; Aromatics; Pyrans, Piperidines & Piperazines; Heterocyclic Building Blocks

1-Boc-4-cyanopiperidine Safety Profile

Risk Statements: 20/21/22
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 36-36/37/39
S36:Wear suitable protective clothing.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
RIDADR: 3439
Hazard Note: Harmful
HazardClass: 6.1
PackingGroup: III

1-Boc-4-cyanopiperidine Specification

1-Boc-4-cyanopiperidine (CAS NO.91419-52-2) is also named as 1-Piperidinecarboxylic acid, 4-cyano-, 1,1-dimethylethyl ester ; 2-Methyl-2-propanyl 4-cyano-1-piperidinecarboxylate ; tert-Butyl 4-cyanopiperidine-1-carboxylate ; 1-Boc-piperidine-4-carbonitrile ; 1-N-Boc-4-cyanopiperidine ; 1-N-Boc-4-cyano-piperidine ; 4-Cyano-piperidine-1-carboxylic acid tert-butyl ester . 1-Boc-4-cyanopiperidine (CAS NO.91419-52-2) is yellowish oil.

Product Name

1-Boc-4-cyanopiperidine

1-Boc-4-cyanopiperidine Chemical Properties

1-Boc-4-cyanopiperidine Safety Profile

1-Boc-4-cyanopiperidine Specification

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