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151213-40-0

Basic Information
CAS No.: 151213-40-0
Name: CIS-OCTAHYDROPYRROLO[3,4-B]PYRIDINE
Article Data: 30
Molecular Structure:
Molecular Structure of 151213-40-0 (CIS-OCTAHYDROPYRROLO[3,4-B]PYRIDINE)
Formula: C7H14N2
Molecular Weight: 126.202
Synonyms: 1H-Pyrrolo[3,4-beta]pyridine,octahydro-, (4alphaS-cis)-;
EINECS: 604-778-8
Density: 0.95 g/cm3
Boiling Point: 198.5 °C at 760 mmHg
Flash Point: 87.1 °C
Appearance: Light pink oil
Hazard Symbols: Xn
Risk Codes: 41
Safety: 26
PSA: 24.06000
LogP: 0.61540
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Chemistry

Molecular Structure of 1H-Pyrrolo[3,4-beta]pyridine,octahydro-, (4alphaS,7alphaS)- (CAS NO.151213-40-0):

Systematic Name: (4alphaS,7alphaS)-octahydro-1H-pyrrolo[3,4-beta]pyridine 
Empirical Formula: C7H14N2
Molecular Weight: 126.1995
Nominal Mass: 126
Average Mass: 126.1995
Monoisotopic Mass: 126.115698 
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 0 
Index of Refraction: 1.469
Molar Refractivity: 37.03 cm3
Molar Volume: 132.7 cm3
Surface Tension: 31.5 dyne/cm
Density: 0.95 g/cm3
Flash Point: 87.1 °C
Enthalpy of Vaporization: 43.47 kJ/mol
Boiling Point: 198.5 °C at 760 mmHg
Vapour Pressure: 0.358 mmHg at 25 °C
Product Categories: pharmacetical; Chiral Reagents; Heterocycles 
SMILES: N2C[C@H]1NCCC[C@H]1C2
InChI: InChI=1/C7H14N2/c1-2-6-4-8-5-7(6)9-3-1/h6-9H,1-5H2/t6-,7+/m0/s1
InChIKey: KSCPLKVBWDOSAI-NKWVEPMBBP

Specification

  1H-Pyrrolo[3,4-beta]pyridine,octahydro-, (4alphaS,7alphaS)- (CAS NO.151213-40-0), its Synonyms are 1H-Pyrrolo[3,4-beta]pyridine,octahydro-, (4alphaS-cis)-; (1S,6S)-2,8-Diazabicyclo[4.3.0]nonane ; (S,S)-2,8-Diazabicyclo[4.3.0]nonane .