| CAS Number | 1214379-79-9 |
| Catalog Number | AG0014Z1(AGN-PC-07QVSX) |
| Chemical Name | 2-Bromo-1-(Difluoromethyl)-4-Methoxybenzene |
| IUPAC Name | 2-bromo-1-(difluoromethyl)-4-methoxybenzene |
| InChI | InChI=1S/C8H7BrF2O/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4,8H,1H3 |
| InChI Key | WSAKDJNZGGQTJE-UHFFFAOYSA-N |
| MDL Number | MFCD14698633 |
| Molecular Formula | C8H7BrF2O |
| Molecular Weight | 237.0414 |
| SMILES | COC1=CC=C(C(F)F)C(Br)=C1 |
| Synonyms | 1214379-79-9,
3-BROMO-4-(DIFLUOROMETHYL)ANISOLE,
2-bromo-1-(difluoromethyl)-4-methoxybenzene,
DTXSID10673320,
CL8974,
MFCD14698633,
ZINC47203472,
AS-46158,
Benzene, 2-bromo-1-(difluoromethyl)-4-methoxy-,
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| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.965g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.044g/mol |
| Monoisotopic Mass | 235.965g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H320-H335
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Packing Group
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Precautionary statements
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P264-P270-P301+P312-P330
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UN Code
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Certificate of Analysis
Lot Number