| CAS Number | 1461655-72-0 |
| Catalog Number | AG01AG6L(AGN-PC-0WCWX6) |
| Chemical Name | (4-Bromo-2,6-difluorophenyl)methanamine hydrochloride |
| IUPAC Name | (4-bromo-2,6-difluorophenyl)methanamine;hydrochloride |
| InChI | InChI=1S/C7H6BrF2N.ClH/c8-4-1-6(9)5(3-11)7(10)2-4;/h1-2H,3,11H2;1H |
| InChI Key | WVXBSPZRXCEBDW-UHFFFAOYSA-N |
| MDL Number | MFCD12546124 |
| Molecular Formula | C7H7BrClF2N |
| Molecular Weight | 258.4910 |
| SMILES | NCC1=C(F)C=C(Br)C=C1F.[H]Cl |
| Synonyms | 1461655-72-0,
(4-Bromo-2,6-difluorophenyl)methanamine hydrochloride,
4-Bromo-2,6-difluorobenzylamine hydrochloride,
4-Bromo-2,6-difluoro-benzylamine hydrochloride,
A1-04116,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.942g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.491g/mol |
| Monoisotopic Mass | 256.942g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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\N
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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\N
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Precautionary statements
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P261-P280-P301+P312-P302+P352-P305+P351+P338
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UN Code
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\N
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Certificate of Analysis
Lot Number