Basic information
- CAS
183741-80-2- Standard SMILES
COc1ccc(NC(=O)OC(C)(C)C)cn1- InChIKey
BQBSTIXIDDRDHH-UHFFFAOYSA-N- Molecular formula
- C11H16N2O3
- Average molar mass
- 224.26 g/mol
- Monoisotopic mass
- 224.11609237
Names & identifiers
- Preferred name
- tert-Butyl (6-methoxypyridin-3-yl)carbamate
- IUPAC
- tert-butyl N-(6-methoxy-3-pyridinyl)carbamate
- English name
- TERT-BUTYL-N-(6-METHOXY-3-PYRIDYL)CARBAMATE
- Molecular formula
- C11H16N2O3
- Molecular weight
- 224.26
Names & synonyms
183741-80-2tert-Butyl (6-methoxypyridin-3-yl)carbamateDTXSID60376738RefChem:383076DTXCID20327766tert-Butyl-N-(6-methoxy-3-pyridyl)carbamateTert-butyl N-(6-methoxypyridin-3-yl)carbamateMFCD07437873TERT-BUTYL 6-METHOXYPYRIDIN-3-YLCARBAMATE3-(Boc-amino)-6-methoxypyridinetert-butyl N-(6-methoxy-3-pyridyl)carbamate5-(N-Boc-amino)-2-methoxypyridine
Show more names
tert-Butyl (6-methoxypyridin-3-yl)(6-Methoxy-3-pyridinyl)-carbamic acid 1,1-dimethylethyl esterCarbamic acid, N-(6-methoxy-3-pyridinyl)-, 1,1-dimethylethyl ester
AKOS014476021tert-butyl-6-methoxypyridin-3-ylcarbamateCS-0037583(6-Methoxy-pyridin-3-yl)-carbamic acid tert-butyl esterCarbamic acid,N-(6-methoxy-SCHEMBL2748441SCHEMBL29764668BQBSTIXIDDRDHH-UHFFFAOYSA-N
Database identifiers
- CAS
183741-80-2- PubChem CID
- 2763103
- DTXSID
DTXSID60376738
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 60.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 238
Physicochemical properties
- Boiling point
- 278.6 ℃ · 278.6℃
- Density
- 1.146 · 1.146
- Flash point
- 122.3 ℃ · 122.3℃
- storage temp.
- 2 · 2-8°C
- pka
- 12.34 · 12.34±0.70(Predicted)
- Appearance
- Off-white to pale purple Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers48 total
上海康恩博医药科技有限公司17510465506 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
苏州施亚生物科技有限公司17715136450 · [email protected]
南京哈柏医药科技有限公司13376080562 13376090521 · [email protected]
上海辅欣医药科技有限公司021-50872116 13391048226 · [email protected]
Related reactions
12 records
Compound notes
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