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CAS No.: | 915226-39-0 |
---|---|
Name: | (S)-1-N-Boc-3-cyanopiperidine |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C11H18 N2 O2 |
Molecular Weight: | 210.276 |
Synonyms: | (S)-3-Cyanopiperidine-1-carboxylic acid tert-butyl ester |
Density: | 1.07g/cm3 |
Boiling Point: | 325.3°C at 760 mmHg |
Flash Point: | 150.5°C |
PSA: | 53.33000 |
LogP: | 2.09498 |
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Systematic Name: tert-Butyl (3S)-3-cyanopiperidine-1-carboxylate
Synonyms of (S)-1-N-Boc-3-cyanopiperidine (CAS NO.915226-39-0): tert-Butyl (3S)-3-cyanopiperidine-1-carboxylate ; (S)-3-Cyanopiperidine-1-carboxylic acid tert-butyl ester
CAS NO: 915226-39-0
Molecular Formula: C11H18N2O2
Molecular Weight: 210.27
Molecular Structure:
H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 53.33 Å2
Index of Refraction: 1.487
Molar Refractivity: 56.59 cm3
Molar Volume: 196.4 cm3
Surface Tension: 40.7 dyne/cm
Density: 1.07 g/cm3
Flash Point: 150.5 °C
Enthalpy of Vaporization: 56.74 kJ/mol
Boiling Point: 325.3 °C at 760 mmHg
Vapour Pressure: 0.000232 mmHg at 25°C
SMILES: O=C(OC(C)(C)C)N1C[C@@H](C#N)CCC1
InChI: InChI=1/C11H18N2O2/c1-11(2,3)15-10(14)13-6-4-5-9(7-12)8-13/h9H,4-6,8H2,1-3H3/t9-/m1/s1
InChIKey: UEFZTXGFHKPSFS-SECBINFHBM
Std. InChI: InChI=1S/C11H18N2O2/c1-11(2,3)15-10(14)13-6-4-5-9(7-12)8-13/h9H,4-6,8H2,1-3H3/t9-/m1/s1
Std. InChIKey: UEFZTXGFHKPSFS-SECBINFHSA-N