| CAS Number | 356783-15-8 |
| Catalog Number | AG00D5A2(AGN-PC-0WAMZI) |
| Chemical Name | 3,6-Dichloropyrazine-2-carboxylic acid |
| IUPAC Name | 3,6-dichloropyrazine-2-carboxylic acid |
| InChI | InChI=1S/C5H2Cl2N2O2/c6-2-1-8-4(7)3(9-2)5(10)11/h1H,(H,10,11) |
| InChI Key | JKDYBIZSSBHQLV-UHFFFAOYSA-N |
| MDL Number | MFCD14581978 |
| Molecular Formula | C5H2Cl2N2O2 |
| Molecular Weight | 192.9876 |
| SMILES | O=C(C1=NC(Cl)=CN=C1Cl)O |
| Synonyms | 3,6-Dichloropyrazine-2-carboxylic acid,
356783-15-8,
AK128606,
3,6-DICHLORO-2-PYRAZINECARBOXYLIC ACID,
SCHEMBL6377192,
DTXSID80627390,
JKDYBIZSSBHQLV-UHFFFAOYSA-N,
4461AB,
MFCD14581978,
ZINC95093339,
AKOS016000816,
AB70505,
DS-5898,
FCH1143045,
AJ-132433,
AX8250668,
FT-0703331,
C5H2Cl2N2O2,
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| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.949g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.983g/mol |
| Monoisotopic Mass | 191.949g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 63.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number