| CAS Number | 910044-07-4 |
| Catalog Number | AG00H267(AGN-PC-0WG3XD) |
| Chemical Name | 6-bromo-pyridine-2-carboxylic acid tert-butyl ester |
| IUPAC Name | tert-butyl 6-bromopyridine-2-carboxylate |
| InChI | InChI=1S/C10H12BrNO2/c1-10(2,3)14-9(13)7-5-4-6-8(11)12-7/h4-6H,1-3H3 |
| InChI Key | FMFVWFOLGYTRBX-UHFFFAOYSA-N |
| MDL Number | MFCD16036506 |
| Molecular Formula | C10H12BrNO2 |
| Molecular Weight | 258.1118 |
| SMILES | O=C(c1cccc(n1)Br)OC(C)(C)C |
| Synonyms | TERT-BUTYL 6-BROMOPICOLINATE,
910044-07-4,
tert-butyl 6-bromopyridine-2-carboxylate,
6-Bromopyridine-2-carboxylic acid tert-butyl ester,
6-bromo-pyridine-2-carboxylic acid tert-butyl ester,
SCHEMBL594691,
FMFVWFOLGYTRBX-UHFFFAOYSA-N,
MFCD16036506,
ZINC82207514,
AKOS027255544,
AM805435,
AS-39699,
SC-33924,
CS-0038291,
2-Pyridinecarboxylic acid, 6-bromo-, 1,1-dimethylethyl ester,
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| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.115g/mol |
| Monoisotopic Mass | 257.005g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number