Name: ISO-PROPYL ACRYLATE
SKU: 689-12-3

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Basic Information

Molecular Structure:
CAS No.:	689-12-3
Name:	ISO-PROPYL ACRYLATE
Article Data:	19

Formula:	C₆H₁₀O₂
Molecular Weight:	114.144
Synonyms:	Acrylicacid, isopropyl ester (6CI,8CI);Isopropyl 2-propenoate;NSC 32619;
EINECS:	211-710-7
Density:	0.902 g/cm³
Melting Point:	37.22°C (estimate)
Boiling Point:	113.892 °C at 760 mmHg
Flash Point:	22.933 °C
Risk Codes:	36/37/38
Safety:	26-36
PSA:	26.30000
LogP:	1.12400

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Specification

The Isopropyl acrylate, with the CAS registry number 689-12-3, is also known as Isopropyl 2-propenoate. It belongs to the product category of Monomer. Its EINECS number is 211-710-7. This chemical's molecular formula is C₆H₁₀O₂ and molecular weight is 114.14. What's more, its systematic name is Isopropyl acrylate.

Physical properties of Isopropyl acrylate are: (1)ACD/LogP: 1.651; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.65; (4)ACD/LogD (pH 7.4): 1.65; (5)ACD/BCF (pH 5.5): 10.59; (6)ACD/BCF (pH 7.4): 10.59; (7)ACD/KOC (pH 5.5): 188.49; (8)ACD/KOC (pH 7.4): 188.49; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.409; (14)Molar Refractivity: 31.305 cm³; (15)Molar Volume: 126.528 cm³; (16)Polarizability: 12.41×10^-24cm³; (17)Surface Tension: 24.7 dyne/cm; (18)Density: 0.902 g/cm³; (19)Flash Point: 22.933 °C; (20)Enthalpy of Vaporization: 35.236 kJ/mol; (21)Boiling Point: 113.892 °C at 760 mmHg; (22)Vapour Pressure: 20.4 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)C)\C=C
(2)Std. InChI: InChI=1S/C6H10O2/c1-4-6(7)8-5(2)3/h4-5H,1H2,2-3H3
(3)Std. InChIKey: LYBIZMNPXTXVMV-UHFFFAOYSA-N