Name: ethyl 2-[(1E)-cyclopropylidene]acetate
SKU: 74592-36-2

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Basic Information

Molecular Structure:
CAS No.:	74592-36-2
Name:	ethyl 2-[(1E)-cyclopropylidene]acetate
Article Data:	20

Formula:	C₇H₁₀O₂
Molecular Weight:	126.155
Synonyms:	Aceticacid, cyclopropylidene-, ethyl ester (9CI);Cyclopropylideneacetic acid ethylester;Ethyl cyclopropylideneacetate;
Density:	1.18 g/cm³
Boiling Point:	167.179 °C at 760 mmHg
Flash Point:	74.125 °C
PSA:	26.30000
LogP:	1.26970

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Specification

The Aceticacid, 2-cyclopropylidene-, ethyl ester with CAS registry number of 74592-36-2 is also known as Aceticacid, cyclopropylidene-, ethyl ester (9CI). The systematic name is Ethyl cyclopropylideneacetate. In addition, the formula is C₇H₁₀O₂ and the molecular weight is 126.15.

Physical properties about Aceticacid, 2-cyclopropylidene-, ethyl ester are: (1)ACD/LogP: 1.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 14; (6)ACD/BCF (pH 7.4): 14; (7)ACD/KOC (pH 5.5): 226; (8)ACD/KOC (pH 7.4): 226; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3Å²; (13)Index of Refraction: 1.583; (14)Molar Refractivity: 35.758 cm³; (15)Molar Volume: 106.947 cm³; (16)Polarizability: 14.175×10^-24cm³; (17)Surface Tension: 54.17 dyne/cm; (18)Density: 1.18 g/cm³; (19)Flash Point: 74.125 °C; (20)Enthalpy of Vaporization: 40.364 kJ/mol; (21)Boiling Point: 167.179 °C at 760 mmHg; (22)Vapour Pressure: 1.721 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: O=C(OCC)\C=C1/CC1
2. InChI: InChI=1/C7H10O2/c1-2-9-7(8)5-6-3-4-6/h5H,2-4H2,1H3
3. InChIKey: CINXGNHRKLMYRK-UHFFFAOYAS
4. Std. InChI: InChI=1S/C7H10O2/c1-2-9-7(8)5-6-3-4-6/h5H,2-4H2,1H3
5. Std. InChIKey: CINXGNHRKLMYRK-UHFFFAOYSA-N