| CAS Number | 138891-58-4 |
| Catalog Number | AG0019RY(AGN-PC-0041SD) |
| Chemical Name | Imidazo[1,5-a]pyridine-1-carboxylic acid, 3-bromo-, ethyl ester |
| IUPAC Name | ethyl 3-bromoimidazo[1,5-a]pyridine-1-carboxylate |
| InChI | InChI=1S/C10H9BrN2O2/c1-2-15-9(14)8-7-5-3-4-6-13(7)10(11)12-8/h3-6H,2H2,1H3 |
| InChI Key | WLURNWOLAWZBPA-UHFFFAOYSA-N |
| MDL Number | MFCD17926422 |
| Molecular Formula | C10H9BrN2O2 |
| Molecular Weight | 269.0947 |
| SMILES | O=C(C1=C2C=CC=CN2C(Br)=N1)OCC |
| Synonyms | ETHYL 3-BROMOIMIDAZO[1,5-A]PYRIDINE-1-CARBOXYLATE,
138891-58-4,
SCHEMBL16516735,
DTXSID80569488,
WLURNWOLAWZBPA-UHFFFAOYSA-N,
MFCD17926422,
ZINC34492110,
PB11729,
AK200158,
AS-37838,
AB0076439,
AX8266844,
CS-0054686,
Q-2736,
3-Bromoimidazo[1,5-a]pyridine-1-carboxylic acid ethyl ester,
Imidazo[1,5-a]pyridine-1-carboxylic acid, 3-bromo-, ethyl ester,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.098g/mol |
| Monoisotopic Mass | 267.985g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
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-P280-P301+P312-P302+P352-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number