2-(1-Pyrrolidinyl)-3-pyridinecarboxaldehyde supplier

Name
2-(1-PYRROLIDINYL)NICOTINALDEHYDE
EINECS
CAS No. 690632-39-4
Article Data2
CAS DataBase
Density 1.183 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₂N₂O
Boiling Point 334 ºC at 760 mmHg
Molecular Weight 176.218
Flash Point 155.8 ºC
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(1-Pyrrolidinyl)-3-pyridinecarboxaldehyde;2-(1-Pyrrolidinyl)nicotinealdehyde;
PSA 33.20000
LogP 1.55930

2-(1-Pyrrolidinyl)-3-pyridinecarboxaldehyde Specification

The 2-(1-Pyrrolidinyl)-3-pyridinecarboxaldehyde with the cas number 690632-39-4 is also called 3-Pyridinecarboxaldehyde,2-(1-pyrrolidinyl)-. Its molecular formula is C₁₀H₁₂N₂O. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 0.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.72; (4)ACD/LogD (pH 7.4): 0.92; (5)ACD/BCF (pH 5.5): 1.87; (6)ACD/BCF (pH 7.4): 2.93; (7)ACD/KOC (pH 5.5): 47.92; (8)ACD/KOC (pH 7.4): 74.89; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 33.2 Å²; (13)Index of Refraction: 1.605; (14)Molar Refractivity: 51.3 cm³; (15)Molar Volume: 148.8 cm³; (16)Polarizability: 20.33×10^-24cm³; (17)Surface Tension: 53.9 dyne/cm; (18)Enthalpy of Vaporization: 57.69 kJ/mol; (19)Vapour Pressure: 0.000132 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1c(nccc1)N2CCCC2
(2)InChI: InChI=1/C10H12N2O/c13-8-9-4-3-5-11-10(9)12-6-1-2-7-12/h3-5,8H,1-2,6-7H2
(3)InChIKey: FTACFSVJFQMXQE-UHFFFAOYAG

Product Name

2-(1-PYRROLIDINYL)NICOTINALDEHYDE

2-(1-Pyrrolidinyl)-3-pyridinecarboxaldehyde Specification

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