CAS No.76649-25-7,TRANS,CIS-3,6-NONADIEN-1-OL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	76649-25-7
Name:	TRANS,CIS-3,6-NONADIEN-1-OL
Article Data:	2

Formula:	C₉H₁₆O
Molecular Weight:	140.225
Synonyms:	(3E,6E)-3,6-Nonadien-1-ol;3,6-Nonadien-1-ol, (E,Z)-;(3E,6E)-Nona-3,6-dien-1-ol;
EINECS:	278-518-3
Density:	0.866 g/cm³
Boiling Point:	214.7 °C at 760 mmHg
Flash Point:	84.6 °C
Appearance:	colourless to slightly yellow liquid
PSA:	20.23000
LogP:	2.28130

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Specification

The 3,6-Nonadien-1-ol, with the CAS registry number 76649-25-7, is also known as (3E,6E)-Nona-3,6-dien-1-ol. Its EINECS number is 278-518-3. This chemical's molecular formula is C₉H₁₆O and molecular weight is 140.22. What's more, its IUPAC name is (3E,6E)-nona-3,6-dien-1-ol. It should be sealed and stored in a cool and dry place. What's more, it should be protected from oxidants.

Physical properties of 3,6-Nonadien-1-ol are: (1)ACD/LogP: 2.69; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 9.23 Å²; (7)Index of Refraction: 1.472; (8)Molar Refractivity: 45.39 cm³; (9)Molar Volume: 161.8 cm³; (10)Polarizability: 17.99×10^-24cm³; (11)Surface Tension: 30.8 dyne/cm; (12)Density: 0.866 g/cm³; (13)Flash Point: 84.6 °C; (14)Enthalpy of Vaporization: 52.46 kJ/mol; (15)Boiling Point: 214.7 °C at 760 mmHg; (16)Vapour Pressure: 0.0336 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCC=CCC=CCCO
(2)Isomeric SMILES: CC/C=C/C/C=C/CCO
(3)InChI: InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h3-4,6-7,10H,2,5,8-9H2,1H3/b4-3+,7-6+
(4)InChIKey: PICGPEBVZGCYBV-FZWLCVONSA-N