Ethyl 1-methylcyclopropane-1-carboxylate supplier

Name
ETHYL 1-METHYLCYCLOPROPANE-1-CARBOXYLATE
EINECS 275-461-6
CAS No. 71441-76-4
Article Data8
CAS DataBase
Density 1.019g/cm³
Solubility
Melting Point
Formula C₇H₁₂O₂
Boiling Point 140.663 °C at 760 mmHg
Molecular Weight 128.171
Flash Point 30.556 °C
Transport Information
Appearance
Safety 16
Risk Codes 10
Molecular Structure
Hazard Symbols F
Synonyms 1-Methylcyclopropanecarboxylicacid ethyl ester;Ethyl 1-methylcyclopropanecarboxylate;
PSA 26.30000
LogP 1.34960

Ethyl 1-methylcyclopropane-1-carboxylate Specification

The Cyclopropanecarboxylicacid, 1-methyl-, ethyl ester, with CAS registry number 71441-76-4, belongs to the following product categories: (1)Esters; (2)Ring Systems. It has the systematic name of ethyl 1-methylcyclopropanecarboxylate. This chemical is flammable, so keep it away from sources of ignition.

Physical properties of Cyclopropanecarboxylicacid, 1-methyl-, ethyl ester: (1)ACD/LogP: 1.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.556; (4)ACD/LogD (pH 7.4): 1.556; (5)ACD/BCF (pH 5.5): 8.972; (6)ACD/BCF (pH 7.4): 8.972; (7)ACD/KOC (pH 5.5): 167.384; (8)ACD/KOC (pH 7.4): 167.384; (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: 1.454; (14)Molar Refractivity: 34.032 cm³; (15)Molar Volume: 125.781 cm³; (16)Polarizability: 13.491×10^-24cm³; (17)Surface Tension: 33.472 dyne/cm; (18)Density: 1.019 g/cm³; (19)Flash Point: 30.556 °C; (20)Enthalpy of Vaporization: 37.788 kJ/mol; (21)Boiling Point: 140.663 °C at 760 mmHg; (22)Vapour Pressure: 6.07 mmHg at 25°C.

Preparation: this chemical can be prepared by 2,4-dichloro-2-methyl-butyric acid ethyl ester. This reaction will need reagent Et₄NO₃SC₆H₄Me-p and solvent dimethylsulfoξde. The yield is about 73%.

You can still convert the following datas into molecular structure:
(1)SMILES: CCOC(=O)C1(CC1)C
(2)InChI: InChI=1/C7H12O2/c1-3-9-6(8)7(2)4-5-7/h3-5H2,1-2H3
(3)InChIKey: IZPYNZLFBUQGCZ-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C7H12O2/c1-3-9-6(8)7(2)4-5-7/h3-5H2,1-2H3
(5)Std. InChIKey: IZPYNZLFBUQGCZ-UHFFFAOYSA-N

Product Name

ETHYL 1-METHYLCYCLOPROPANE-1-CARBOXYLATE

Ethyl 1-methylcyclopropane-1-carboxylate Specification

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