| CAS Number | 67784-09-2 |
| Catalog Number | AG00FHPB(AGN-PC-0WANBZ) |
| Chemical Name | 2-Hydroxybut-2-enoic acid |
| IUPAC Name | (Z)-2-hydroxybut-2-enoic acid |
| InChI | InChI=1S/C4H6O3/c1-2-3(5)4(6)7/h2,5H,1H3,(H,6,7)/b3-2- |
| InChI Key | RTWLEDIMOQVWDF-IHWYPQMZSA-N |
| MDL Number | MFCD27996798 |
| Molecular Formula | C4H6O3 |
| Molecular Weight | 102.0886 |
| SMILES | C/C=C(/C(=O)O)O |
| Synonyms | 2-Hydroxybut-2-enoic acid,
67784-09-2,
SCHEMBL1965732,
SCHEMBL1965736,
MFCD27996798,
ZINC24943387,
AJ-81972,
AK149482,
AX8286748,
ST2404440,
2-ketobutyric acid,
2KT,
|
| Complexity | 104 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 102.032g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 102.089g/mol |
| Monoisotopic Mass | 102.032g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number