CAS No.25166-87-4,HEXENAL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	25166-87-4
Name:	HEXENAL
Article Data:	3

Formula:	C₆H₁₀O
Molecular Weight:	98.1448
Synonyms:	4-Hexenal,(E)- (8CI);(E)-4-Hexenal;trans-4-Hexenal;
Density:	0.828 g/cm³
Boiling Point:	127.2 °C at 760 mmHg
Flash Point:	18 °C
PSA:	17.07000
LogP:	1.54160

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Specification

The 4-Hexenal,(4E)- is an organic compound with the formula C₆H₁₀O. The systematic name of this chemical is (4E)-Hex-4-enal. With the CAS registry number 25166-87-4, it is also named as 4-Hexenal. The product's category is Aldehyde Flavor. Besides, its molecular weight is 98.143.

Physical properties about 4-Hexenal,(4E)- are: (1)ACD/LogP: 1.64; (2)ACD/LogD (pH 5.5): 1.64; (3)ACD/LogD (pH 7.4): 1.64; (4)ACD/BCF (pH 5.5): 10.44; (5)ACD/BCF (pH 7.4): 10.44; (6)ACD/KOC (pH 5.5): 186.58; (7)ACD/KOC (pH 7.4): 186.58; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 17.07 Å²; (11)Index of Refraction: 1.421; (12)Molar Refractivity: 30.09 cm³; (13)Molar Volume: 118.5 cm³; (14)Polarizability: 11.92×10^-24 cm³; (15)Surface Tension: 25.7 dyne/cm; (16)Density: 0.828 g/cm³; (17)Flash Point: 18 °C; (18)Enthalpy of Vaporization: 36.5 kJ/mol; (19)Boiling Point: 127.2 °C at 760 mmHg; (20)Vapour Pressure: 11.3 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C6H10O/c1-2-3-4-5-6-7/h2-3,6H,4-5H2,1H3/b3-2+
(2)InChIKey: DPCMFIRORYQTCL-NSCUHMNNBX
(3)Std. InChI: InChI=1S/C6H10O/c1-2-3-4-5-6-7/h2-3,6H,4-5H2,1H3/b3-2+
(4)Std. InChIKey: DPCMFIRORYQTCL-NSCUHMNNSA-N