Benzaldehyde,4-(4-morpholinylmethyl)- supplier

Name
4-(MORPHOLINOMETHYL)BENZALDEHYDE
EINECS
CAS No. 82413-63-6
Article Data15
CAS DataBase
Density 1.149 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₅NO₂
Boiling Point 328.4 °C at 760 mmHg
Molecular Weight 205.257
Flash Point 152.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(Morpholin-4-ylmethyl)benzaldehyde;4-Morpholinomethylbenzaldehyde;
PSA 29.54000
LogP 1.26920

Benzaldehyde,4-(4-morpholinylmethyl)- Specification

The Benzaldehyde,4-(4-morpholinylmethyl)-, with the CAS registry number 82413-63-6, is also known as 4-Morpholinomethylbenzaldehyde. This chemical's molecular formula is C₁₂H₁₅NO₂ and molecular weight is 205.25. What's more, its systematic name is 4-Morpholinomethylbenzaldehyde.

Physical properties about Benzaldehyde,4-(4-morpholinylmethyl)- are: (1) ACD/LogP: 0.60; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): -0.62; (4) ACD/LogD (pH 7.4): 0.52; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1.4; (7) ACD/KOC (pH 5.5): 3.07; (8) ACD/KOC (pH 7.4): 42.09; (9) #H bond acceptors: 3; (10) #H bond donors: 0; (11) #Freely Rotating Bonds: 3; (12) Polar Surface Area: 29.54 Å²; (13) Index of Refraction: 1.581; (14) Molar Refractivity: 59.53 cm³; (15) Molar Volume: 178.5 cm³; (16) Polarizability: 23.6×10^-24cm³; (17) Surface Tension: 47.3 dyne/cm; (18) Density: 1.149 g/cm³; (19) Flash Point: 152.4 °C; (20) Enthalpy of Vaporization: 57.08 kJ/mol; (21) Boiling Point: 328.4 °C at 760 mmHg; (22) Vapour Pressure: 0.00019 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1ccc(cc1)CN2CCOCC2
(2) InChI: InChI=1/C12H15NO2/c14-10-12-3-1-11(2-4-12)9-13-5-7-15-8-6-13/h1-4,10H,5-9H2
(3) InChIKey: KMAHWHPUXGNVBN-UHFFFAOYAL

Product Name

4-(MORPHOLINOMETHYL)BENZALDEHYDE

Benzaldehyde,4-(4-morpholinylmethyl)- Specification

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