compound introduction
2,3-二羟基 -2,3-去氢苯甲酸是一种环己二烯羧酸，其 C=C 键位于 1-和 3-位，羧基位于 1-位，两个羟基取代基分别位于 5-和 6-位。它是一种环己二烯羧酸和一个α,β-不饱和一元羧酸。它是 2,3-二羟基 -2,3-去氢苯甲酸盐的共轭酸。
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5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid
CAS number：100459-00-5 molecular formula：C7H8O4
overview
Specs
| Chinese alias | - | ||
| English alias | - | ||
| CAS number | 100459-00-5 | molecular formula | C7H8O4 |
| molecular weight | 156.14 | Exact mass | - |
| PSA | 77.8 | logp | -0.3 |
numbering system
| CAS | 100459-00-5 |
| ChEBI ID | 15941 |
| Wikidata | Q27098309 |
| PubChem CID | 3 |
| Nikkaji Number | J2.365.935B |
| DSSTox Substance ID | DTXSID30274252 |
| PubChem Reference Collection SID | 518163546 |
physicochemical properties
| XLogP3 | XLogP3-AA: -0.3 |
| Complexity | 229 |
| Exact Mass | 156.04225873 |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Molecular Weight | 156.14 |
| Monoisotopic Mass | 156.04225873 |
| Isotope Atom Count | 0 |
| Rotatable Bond Count | 1 |
| Hydrogen Bond Donor Count | 3 |
| Covalently-Bonded Unit Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Topological Polar Surface Area | 77.8 Ų |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
Safety information
No safety information yet
Production methods and uses
No production method and use information yet
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upstream information
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downstream information
No downstream information yet
MSDS
Found 0 shareMSDS
