| CAS Number | 1357172-39-4 |
| Catalog Number | AG009WJB(AGN-PC-0BRSIU) |
| Chemical Name | 3,6-Dichloropyrazine-2-carbaldehyde |
| IUPAC Name | 3,6-dichloropyrazine-2-carbaldehyde |
| InChI | InChI=1S/C5H2Cl2N2O/c6-4-1-8-5(7)3(2-10)9-4/h1-2H |
| InChI Key | HEGCEYZLDWHQMS-UHFFFAOYSA-N |
| MDL Number | MFCD22548401 |
| Molecular Formula | C5H2Cl2N2O |
| Molecular Weight | 176.9882 |
| SMILES | O=Cc1nc(Cl)cnc1Cl |
| Synonyms | 3,6-Dichloropyrazine-2-carbaldehyde,
1357172-39-4,
AK134684,
DTXSID60720833,
KS-000004BB,
6377AA,
MFCD22548401,
ZINC95093431,
AKOS016842675,
AB85727,
DS-4803,
FCH2006897,
SB11245,
AJ-132521,
AX8256452,
ST2404661,
4CH-017522,
C5H2Cl2N2O,
1188025-81-1,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.954g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.984g/mol |
| Monoisotopic Mass | 175.954g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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