5-Morpholin-4-yl-2-furaldehyde supplier

Name
5-MORPHOLIN-4-YL-FURAN-2-CARBALDEHYDE
EINECS
CAS No. 3680-96-4
Article Data8
CAS DataBase
Density 1.23 g/cm³
Solubility
Melting Point
Formula C₉H₁₁NO₃
Boiling Point 354.5 °C at 760 mmHg
Molecular Weight 181.19
Flash Point 168.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Furaldehyde,5-morpholino- (7CI,8CI);5-Morpholino-2-furancarboxaldehyde;5-Morpholinofurfural;
PSA 42.68000
LogP 0.99370

5-Morpholin-4-yl-2-furaldehyde Specification

The systematic name of 5-Morpholin-4-yl-2-furaldehyde is 5-(morpholin-4-yl)furan-2-carbaldehyde. With the CAS registry number 3680-96-4, it is also named as 5-(Morpholin-4-yl)furan-2-carbaldehyde. The product's molecular formula is C₉H₁₁NO₃ and its molecular weight is 181.19.

The other characteristics of 5-Morpholin-4-yl-2-furaldehyde can be summarized as: (1)ACD/LogP: -0.13 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): -0.13 ; (4)ACD/LogD (pH 7.4): -0.13 ; (5)ACD/BCF (pH 5.5): 1 ; (6)ACD/BCF (pH 7.4): 1 ; (7)ACD/KOC (pH 5.5): 20.29 ; (8)ACD/KOC (pH 7.4): 20.29 ; (9)H bond acceptors: 4 ; (10)H bond donors: 0 ; (11)Freely Rotating Bonds: 2; (12)Index of Refraction: 1.553 ; (13)Molar Refractivity: 47.11 cm³ ; (14)Molar Volume: 147.2 cm³; (15)Surface Tension: 46 dyne/cm ; (16)Density: 1.23 g/cm³ ; (17)Flash Point: 168.2 °C ; (18)Enthalpy of Vaporization: 59.95 kJ/mol ; (19)Boiling Point: 354.5 °C at 760 mmHg ; (20)Vapour Pressure: 3.34E-05 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:O=Cc2oc(N1CCOCC1)cc2;
(2)InChI:InChI=1/C9H11NO3/c11-7-8-1-2-9(13-8)10-3-5-12-6-4-10/h1-2,7H,3-6H2;
(3)InChIKey:XPUSBRXFPCGEKP-UHFFFAOYAV;
(4)Std. InChI:InChI=1S/C9H11NO3/c11-7-8-1-2-9(13-8)10-3-5-12-6-4-10/h1-2,7H,3-6H2;
(5)Std. InChIKey:XPUSBRXFPCGEKP-UHFFFAOYSA-N.

Product Name

5-MORPHOLIN-4-YL-FURAN-2-CARBALDEHYDE

5-Morpholin-4-yl-2-furaldehyde Specification

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