CAS No.6283-86-9,2-ethylhexyl lactate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	6283-86-9
Name:	2-ethylhexyl lactate
Article Data:	9

Formula:	C₁₁H₂₂O₃
Molecular Weight:	202.294
Synonyms:	Lacticacid, 2-ethylhexyl ester (6CI,8CI);2-Ethyl-1-hexanol lactate;2-Ethyl-1-hexyl2-hydroxypropanoate;2-Ethylhexyl lactate;NSC 7737;PuraSolve EHL;PurasolvEHL;
EINECS:	228-503-2
Density:	0.954 g/cm³
Boiling Point:	243 °C at 760 mmHg
Flash Point:	99.2 °C
Solubility:	429mg/L at 20℃
PSA:	46.53000
LogP:	2.12680

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Specification

The CAS registry number of Propanoic acid,2-hydroxy-, 2-ethylhexyl ester is 6283-86-9. This chemical is also named as 2-Ethyl hexyl lactate. Its EINECS registry number is 228-503-2. In addition, its molecular formula is C₁₁H₂₂O₃ and molecular weight is 202.2906. Its systematic name and IUPAC name are the same which is called 2-ethylhexyl 2-hydroxypropanoate.

Physical properties about Propanoic acid,2-hydroxy-, 2-ethylhexyl ester are: (1)ACD/LogP: 2.82; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.82; (4)ACD/LogD (pH 7.4): 2.82; (5)ACD/BCF (pH 5.5): 81.4; (6)ACD/BCF (pH 7.4): 81.4; (7)ACD/KOC (pH 5.5): 811.41; (8)ACD/KOC (pH 7.4): 811.4; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 9; (12)Index of Refraction: 1.443; (13)Molar Refractivity: 56.23 cm³; (14)Molar Volume: 211.8 cm³; (15)Surface Tension: 32.5 dyne/cm; (16)Density: 0.954 g/cm³; (17)Flash Point: 99.2 °C; (18)Enthalpy of Vaporization: 55.78 kJ/mol; (19)Boiling Point: 243 °C at 760 mmHg; (20)Vapour Pressure: 0.00558 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC(CCCC)CC)C(O)C
(2)InChI: InChI=1/C11H22O3/c1-4-6-7-10(5-2)8-14-11(13)9(3)12/h9-10,12H,4-8H2,1-3H3
(3)InChIKey: FECDACOUYKFOOP-UHFFFAOYAF