Benzaldehyde,2-(1-piperidinyl)- supplier

Name
2-PIPERIDIN-1-YL-BENZALDEHYDE
EINECS
CAS No. 34595-26-1
Article Data35
CAS DataBase
Density 1.091 g/cm³
Solubility
Melting Point 95 °C(Solv: ethanol (64-17-5))
Formula C₁₂H₁₅NO
Boiling Point 323.8 °C at 760 mmHg
Molecular Weight 189.257
Flash Point 124.9 °C
Transport Information
Appearance
Safety 26
Risk Codes 36-52
Molecular Structure
Hazard Symbols Xi
Synonyms 2-(Piperidin-1-yl)benzaldehyde;2-(Piperidino)benzaldehyde;o-Piperidinobenzaldehyde;
PSA 20.31000
LogP 2.55440

Benzaldehyde,2-(1-piperidinyl)- Specification

The Benzaldehyde, 2-(1-piperidinyl)-, with the CAS registry number of 34595-26-1, is also known as 2-Piperidinobenzenecarbaldehyde and 2-(1-Piperidinyl)benzaldehyde. This chemical's molecular formula is C₁₂H₁₅NO and molecular weight is 189.25. What's more, its IUPAC name is 2-Piperidin-1-ylbenzaldehyde.

Physical properties about are: (1)ACD/LogP: 2.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.37; (4)ACD/LogD (pH 7.4): 2.4; (5)ACD/BCF (pH 5.5): 36.72; (6)ACD/BCF (pH 7.4): 39.34; (7)ACD/KOC (pH 5.5): 449.89; (8)ACD/KOC (pH 7.4): 482.08; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.31 Å²; (13)Index of Refraction: 1.581; (14)Molar Refractivity: 57.82 cm³; (15)Molar Volume: 173.3 cm³; (16)Polarizability: 22.92×10^-24 cm³; (17)Surface Tension: 44.5 dyne/cm; (18)Density: 1.091 g/cm³; (19)Flash Point: 124.9 °C; (20)Enthalpy of Vaporization: 56.58 kJ/mol; (21)Boiling Point: 323.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000255 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1ccccc1N2CCCCC2
(2) InChI: InChI=1/C12H15NO/c14-10-11-6-2-3-7-12(11)13-8-4-1-5-9-13/h2-3,6-7,10H,1,4-5,8-9H2
(3) InChIKey: SMABIQIPGVQEEX-UHFFFAOYAB

Product Name

2-PIPERIDIN-1-YL-BENZALDEHYDE

Benzaldehyde,2-(1-piperidinyl)- Specification

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