SU8
(2R)-2-butylbutanedioic acid
Created: | 2014-07-25 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 26 |
Chiral Atom Count | 1 |
Bond Count | 25 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2R)-2-butylbutanedioic acid |
Synonyms | (2R)-2-butylsuccinic acid |
Systematic Name (OpenEye OEToolkits) | (2R)-2-butylbutanedioic acid |
Formula | C8 H14 O4 |
Molecular Weight | 174.194 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(CC(=O)O)CCCC |
SMILES | CACTVS | 3.385 | CCCC[CH](CC(O)=O)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.6 | CCCCC(CC(=O)O)C(=O)O |
Canonical SMILES | CACTVS | 3.385 | CCCC[C@H](CC(O)=O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | CCCC[C@H](CC(=O)O)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C8H14O4/c1-2-3-4-6(8(11)12)5-7(9)10/h6H,2-5H2,1H3,(H,9,10)(H,11,12)/t6-/m1/s1 |
InChIKey | InChI | 1.03 | WOPLHDNLGYOSPG-ZCFIWIBFSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 92201348 |