| CAS Number | 886371-39-7 |
| Catalog Number | AG00GS2R(AGN-PC-0WCZ8P) |
| Chemical Name | (2-bromo-1-methyl-1H-imidazol-5-yl)methanol |
| IUPAC Name | (2-bromo-3-methylimidazol-4-yl)methanol |
| InChI | InChI=1S/C5H7BrN2O/c1-8-4(3-9)2-7-5(8)6/h2,9H,3H2,1H3 |
| InChI Key | PZILGIABAGMOHI-UHFFFAOYSA-N |
| MDL Number | MFCD07374352 |
| Molecular Formula | C5H7BrN2O |
| Molecular Weight | 191.0259 |
| SMILES | CN1C(CO)=CN=C1Br |
| Synonyms | 886371-39-7,
(2-BROMO-1-METHYL-1H-IMIDAZOL-5-YL)METHANOL,
(2-Bromo-3-methyl-3H-imidazol-4-yl)methanol,
2-BROMO-1-METHYL-1H-IMIDAZOLE-5-METHANOL,
J-500648,
(2-BROMO-3-METHYL-3H-IMIDAZOL-4-YL)-METHANOL,
DTXSID40680946,
FCH855815,
ZINC64033485,
AKOS006285096,
AB39257,
RP25052,
AK-26401,
AJ-114594,
AX8023585,
DB-078078,
FT-0752549,
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| Complexity | 101 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.028g/mol |
| Monoisotopic Mass | 189.974g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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