CAS No.24587-53-9,(S)-1-OCTEN-3-OL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	24587-53-9
Name:	(S)-1-OCTEN-3-OL
Article Data:	57

Formula:	C₈H₁₆O
Molecular Weight:	128.214
Synonyms:	1-Octen-3-ol, (S)- (8CI);(+)-1-Octen-3-ol;(S)-(+)-1-Octen-3-ol;(S)-1-Octen-3-ol;(S)-Matsutake alcohol;
Density:	0.834 g/cm³
Boiling Point:	168.4 °C at 760 mmHg
Flash Point:	61.1 °C
Hazard Symbols:	Xn
Risk Codes:	22-36/38
Safety:	26
PSA:	20.23000
LogP:	2.11360

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Specification

The 1-Octen-3-ol, (3S)-, with the CAS registry number of 24587-53-9, is also known as (S)-(+)-Octen-3-ol. It belongs to the product categories of Alcohols. This chemical's molecular formula is C₈H₁₆O and molecular weight is 128.21. What's more, its systematic name is (3S)-Oct-1-en-3-ol.

Physical properties about 1-Octen-3-ol, (3S)- are: (1)ACD/LogP: 2.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.64; (4)ACD/LogD (pH 7.4): 2.64; (5)ACD/BCF (pH 5.5): 59.95; (6)ACD/BCF (pH 7.4): 59.95; (7)ACD/KOC (pH 5.5): 651.85; (8)ACD/KOC (pH 7.4): 651.85; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.438; (14)Molar Refractivity: 40.33 cm³; (15)Molar Volume: 153.5 cm³; (16)Polarizability: 15.98×10^-24 cm³; (17)Surface Tension: 28 dyne/cm; (18)Density: 0.834 g/cm³; (19)Flash Point: 61.1 °C Enthalpy of; (20)Vaporization: 47.13 kJ/mol; (21)Boiling Point: 168.4 °C at 760 mmHg; (22)Vapour Pressure: 0.531 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. As a chemical, it is irritating to eyes and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. In addition, this chemical is harmful if swallowed.

You can still convert the following datas into molecular structure:
(1) SMILES: O[C@H](\C=C)CCCCC
(2) InChI: InChI=1/C8H16O/c1-3-5-6-7-8(9)4-2/h4,8-9H,2-3,5-7H2,1H3/t8-/m1/s1
(3) InChIKey: VSMOENVRRABVKN-MRVPVSSYBU