Basic information
- CAS
497159-91-8- Standard SMILES
Cc1cc(Br)cnc1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C- InChIKey
ARLXOZWDGQGERD-UHFFFAOYSA-N- Molecular formula
- C16H23BrN2O4
- Average molar mass
- 387.27 g/mol
- Monoisotopic mass
- 386.08411932
Names & identifiers
- Preferred name
- 2-(N,N-BisBOC-amino)-5-bromo-3-methylpyridine
- IUPAC
- tert-butyl N-(5-bromo-3-methyl-2-pyridinyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
- English name
- DI-TERT-BUTYL [5-BROMO-3-METHYLPYRIDIN-2-YL]IMIDODICARBONATE
- Molecular formula
- C16H23BrN2O4
- Molecular weight
- 387.27
Names & synonyms
497159-91-82-(N,N-BisBOC-amino)-5-bromo-3-methylpyridineDi-tert-butyl [5-bromo-3-methylpyridin-2-yl]imidodicarbonateMFCD11111840tert-butyl N-(5-bromo-3-methylpyridin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamatedi-tert-butyl 5-bromo-3-methylpyridin-2-yliminodicarbonate2-(N,N- di-tert-butoxycarbonylamino) -3- methyl -5- bromopyridine1,3-Bis(1,1-dimethylethyl) 2-(5-bromo-3-methyl-2-pyridinyl)imidodicarbonateDi-tert-butyl[5-bromo-3-methylpyridin-2-yl]imidodicarbonateSCHEMBL1958367SCHEMBL31268069DTXSID40621874
Show more names
DI-TERT-BUTYL [5-BROMO-3-trifluoroMETHYLPYRIDIN-2-YL]IMIDODICARBONATEImidodicarbonic acid, 2-(5-bromo-3-methyl-2-pyridinyl)-, 1,3-bis(1,1-dimethylethyl) ester
ARLXOZWDGQGERD-UHFFFAOYSA-NAKOS015892240BS-28825DB-071043DB-259135CS-02110411,2-Propane diamine,n1,n2,n2,2-tetramethyl-E87895
Database identifiers
- CAS
497159-91-8- PubChem CID
- 22036040
- DTXSID
DTXSID40621874
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 68.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 414
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers14 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
浙江雅辰药物科技股份有限公司13674959855 13674959855 · [email protected]
郑州药领医药科技有限公司13526569071 · [email protected]
苏州岚云医药科技有限公司2332782371 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海波以尔化工有限公司021-50182298 021-50180596 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
1 records
Compound notes
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