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CAS No.: | 56-14-4 |
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Name: | ANION STANDARD - SUCCINATE |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C4H4O4 |
Molecular Weight: | 116.073 |
Synonyms: | Succinicacid, ion(2-) (8CI);Butanedioate;Succinate;Succinate dianion;Succinate ion;Succinate ion(2-);Succinate(2-); |
Density: | g/cm3 |
Boiling Point: | 236.149 °C at 760 mmHg |
Flash Point: | 110.89 °C |
PSA: | 80.26000 |
LogP: | -2.73360 |
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The Butanedioic acid,ion(2-), with the CAS registry number 56-14-4, is also known as Succinate and 1,4-Butanedioate. This chemical's molecular formula is C4H4O4 and molecular weight is 116.0733. What's more, both its IUPAC name and systematic name are the same which is called Butanedioate.
Physical properties about Butanedioic acid,ion(2-) are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 80.26 Å2; (10)Flash Point: 110.89 °C; (11)Enthalpy of Vaporization: 52.092 kJ/mol; (12)Boiling Point: 236.149 °C at 760 mmHg; (13)Vapour Pressure: 0.017 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: C(CC(=O)[O-])C(=O)[O-]
(2) InChI: InChI=1/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)/p-2
(3) InChIKey: KDYFGRWQOYBRFD-NUQVWONBAM