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| CAS No.: | 1186-79-4 |
|---|---|
| Name: | 2,3-DIETHYLSUCCINIC ACID |
| Article Data: | 4 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C8H14O4 |
| Molecular Weight: | 174.197 |
| Synonyms: | Succinicacid, 2,3-diethyl- (6CI,7CI,8CI);2,3-Diethylsuccinic acid;3,4-Hexanedicarboxylic acid; |
| Density: | 1.156 g/cm3 |
| Melting Point: | 132-133℃ |
| Boiling Point: | 274 °C at 760 mmHg |
| Flash Point: | 133.7 °C |
| PSA: | 74.60000 |
| LogP: | 1.20800 |
- 118684-32-5Carbamic acid, N-[3-(bromomethyl)phenyl]-,1,1-dimethylethyl ester
- 118688-56-5Benzene,1,3,5-tris(2-phenylethynyl)-
- 118689-07-92-(2,4-difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol
- 118693-22-42H-1-Benzopyran-3-carboxylicacid, 6,8-dichloro-, methyl ester
- 118-69-4Benzene,1,3-dichloro-2-methyl-
- 1186-98-7Butanedioic acid,2,3-dibromo-, 1,4-dimethyl ester, (2R,3R)-rel-
- 1187-03-7Urea,N,N,N',N'-tetraethyl-
- 118705-01-42-[(3-Amino-2-pyridinyl)amino]ethanol
- 1187058-44-13-(2-methoxyethyl)-1H-pyrazol-5-amine
- 118-70-74,5,6-Pyrimidinetriamine
- Total:24 Page 1 of 1 1
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Specification
The Butanedioic acid, 2, 3-diethyl-, with the CAS registry number of 1186-79-4, is also known as 2, 3-Diethylsuccinic acid. This chemical's molecular formula is C8H14O4 and molecular weight is 174.19. What's more, its systematic name is called 2, 3-Diethylbutanedioic acid.
Physical properties about Butanedioic acid, 2, 3-diethyl- are: (1)ACD/LogP: 1.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.86; (4)ACD/LogD (pH 7.4): -3.13; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 52.6 Å2; (13)Index of Refraction: 1.471; (14)Molar Refractivity: 42.15 cm3; (15)Molar Volume: 150.5 cm3; (16)Surface Tension: 44.4 dyne/cm; (17)Density: 1.156 g/cm3; (18)Flash Point: 133.7 °C; (19)Enthalpy of Vaporization: 56.39 kJ/mol; (20)Boiling Point: 274 °C at 760 mmHg; (21)Vapour Pressure: 0.00153 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)C(CC)C(C(=O)O)CC
(2) InChI: InChI=1/C8H14O4/c1-3-5(7(9)10)6(4-2)8(11)12/h5-6H,3-4H2,1-2H3,(H,9,10)(H,11,12)
(3) InChIKey: KJXMXCRSMLOXBM-UHFFFAOYAQ