| CAS Number | 1125828-26-3 |
| Catalog Number | AG009LWG(AGN-PC-0WAMGS) |
| Chemical Name | 1-(2-Bromo-5-chlorophenyl)-3-methyl-1H-pyrazole |
| IUPAC Name | 1-(2-bromo-5-chlorophenyl)-3-methylpyrazole |
| InChI | InChI=1S/C10H8BrClN2/c1-7-4-5-14(13-7)10-6-8(12)2-3-9(10)11/h2-6H,1H3 |
| InChI Key | QYIGOGBGVKONDY-UHFFFAOYSA-N |
| MDL Number | MFCD14706004 |
| Molecular Formula | C10H8BrClN2 |
| Molecular Weight | 271.5409 |
| SMILES | CC1=NN(C=C1)C1=CC(Cl)=CC=C1Br |
| Synonyms | 1-(2-bromo-5-chlorophenyl)-3-methyl-1h-pyrazole,
1125828-26-3,
99360-59-5,
SCHEMBL2059501,
KS-00000TFV,
QYIGOGBGVKONDY-UHFFFAOYSA-N,
MFCD14706004,
ZINC59098785,
AKOS027253579,
FCH2304487,
SB18266,
AK203550,
DS-10329,
AX8328801,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.956g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.542g/mol |
| Monoisotopic Mass | 269.956g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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