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CAS No.: | 2435-36-1 |
---|---|
Name: | DIMETHYLNORCAMPHORATE |
Article Data: | 17 |
Molecular Structure: | |
Formula: | C9H14O4 |
Molecular Weight: | 186.208 |
Synonyms: | 1,3-Cyclopentanedicarboxylicacid, dimethyl ester (7CI,8CI,9CI);1,3-Bis(methoxycarbonyl)cyclopentane; |
Density: | 1.136 g/cm3 |
Boiling Point: | 240.829 °C at 760 mmHg |
Flash Point: | 112.862 °C |
PSA: | 52.60000 |
LogP: | 0.74870 |
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The dimethyl cyclopentane-1,3-dicarboxylate, with the CAS registry number 2435-36-1, is also known as Dimethyl norcamphorate. This chemical's molecular formula is C9H14O4 and molecular weight is 186.20506. Its IUPAC name is called dimethyl cyclopentane-1,3-dicarboxylate. This chemical's classification code is Skin / Eye Irritant.
Physical properties of dimethyl cyclopentane-1,3-dicarboxylate: (1)ACD/LogP: 0.98; (2)ACD/LogD (pH 5.5): 0.983; (3)ACD/LogD (pH 7.4): 0.983; (4)ACD/BCF (pH 5.5): 3.291; (5)ACD/BCF (pH 7.4): 3.291; (6)ACD/KOC (pH 5.5): 81.644; (7)ACD/KOC (pH 7.4): 81.644; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 4; (10)Index of Refraction: 1.461; (11)Molar Refractivity: 44.96 cm3; (12)Molar Volume: 163.94 cm3; (13)Surface Tension: 38.302 dyne/cm; (14)Density: 1.136 g/cm3; (15)Flash Point: 112.862 °C; (16)Enthalpy of Vaporization: 47.776 kJ/mol; (17)Boiling Point: 240.829 °C at 760 mmHg; (18)Vapour Pressure: 0.037 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC(=O)C1CCC(C1)C(=O)OC
(2)InChI: InChI=1S/C9H14O4/c1-12-8(10)6-3-4-7(5-6)9(11)13-2/h6-7H,3-5H2,1-2H3
(3)InChIKey: SQFQEQDRLAZVJQ-UHFFFAOYSA-N