CAS No.13417-49-7,5,6-dihydro-2H-pyran-3-carbaldehyde Suppliers

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Basic Information

Molecular Structure:
CAS No.:	13417-49-7
Name:	5,6-dihydro-2H-pyran-3-carbaldehyde
Article Data:	8

Formula:	C₆H₈O₂
Molecular Weight:	112.128
Synonyms:	3-Formyl-5,6-dihydro-2H-pyran;5,6-Dihydro-2H-pyran-3-carboxaldehyde;
EINECS:	236-515-4
Density:	1.175 g/cm³
Boiling Point:	201.9 °C at 760 mmHg
Flash Point:	86.6 °C
PSA:	26.30000
LogP:	0.53200

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Specification

The 5,6-Dihydro-2H-pyran-3-carbaldehyde, with CAS registry number 13417-49-7, has the systematic name of 5,6-dihydro-2H-pyran-3-carbaldehyde. And its IUPAC name is 3,6-dihydro-2H-pyran-5-carbaldehyde. And the chemical formula of this chemical is C₆H₈O₂. What's more, its EINECS is 236-515-4.

Physical properties of 5,6-Dihydro-2H-pyran-3-carbaldehyde: (1)ACD/LogP: 0.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 23.93; (8)ACD/KOC (pH 7.4): 23.93; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.56; (14)Molar Refractivity: 30.87 cm³; (15)Molar Volume: 95.3 cm³; (16)Polarizability: 12.23×10^-24cm³; (17)Surface Tension: 50.1 dyne/cm; (18)Enthalpy of Vaporization: 43.81 kJ/mol; (19)Vapour Pressure: 0.3 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C\C1=C\CCOC1
(2)InChI: InChI=1/C6H8O2/c7-4-6-2-1-3-8-5-6/h2,4H,1,3,5H2
(3)InChIKey: RKXCKEHBMLDWET-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C6H8O2/c7-4-6-2-1-3-8-5-6/h2,4H,1,3,5H2
(5)Std. InChIKey: RKXCKEHBMLDWET-UHFFFAOYSA-N