Basic information
- CAS
370880-82-3- Standard SMILES
CC(C)(C)OC(=O)n1ccc2ccncc21- InChIKey
VDJQDKIUIIFWJD-UHFFFAOYSA-N- Molecular formula
- C12H14N2O2
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.10552769
Names & identifiers
- Preferred name
- tert-Butyl 1H-pyrrolo[2,3-c]pyridine-1-carboxylate
- IUPAC
- tert-butyl pyrrolo[2,3-c]pyridine-1-carboxylate
- English name
- N-Boc-6-azaindole
- Molecular formula
- C12H14N2O2
- Molecular weight
- 218.25
Names & synonyms
370880-82-3tert-Butyl 1H-pyrrolo[2,3-c]pyridine-1-carboxylaten-boc-6-azaindoleMFCD20277909TERT-BUTYL PYRROLO[2,3-C]PYRIDINE-1-CARBOXYLATE1-Boc-6-azaindoletert-Butyl1H-pyrrolo[2,3-c]pyridine-1-carboxylate1H-Pyrrolo[2,3-c]pyridine-1-carboxylic acid, 1,1-dimethylethyl esterSCHEMBL653606SCHEMBL28265088DTXSID80627299VDJQDKIUIIFWJD-UHFFFAOYSA-N
Show more names
1H-pyrrolo[2,3-c]pyridine-1-carboxylatePyrrolo[2,3-c]pyridine-1-carboxylic acid tert-butyl estertert-butyl pyrrolo[2,3-c]pyridine-1-carboxylate - [AC80685]
VPA88082AKOS016006628BS-28289SY148531DB-344310EN300-128190F30885F232599
Database identifiers
- CAS
370880-82-3- PubChem CID
- 22646996
- DTXSID
DTXSID80627299
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 273
Physicochemical properties
- Boiling point
- 339.3 · 339.3±34.0 °C(Predicted)
- Density
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 6.2 · 6.20±0.30(Predicted)
- Appearance
- Colorless to light yellow Liquid
Chemistry & industry
Suppliers26 total
韶远科技(上海)有限公司4000665055 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
宁波苯康基石医药科技有限公司15990591583
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
石家庄速晨生物科技有限公司186-33933494 18032288352
上海敏寒医药科技有限公司17612188245 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
北京博恩康达医药科技有限公司13261021908 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
南京斯诺嘉医药科技有限公司188 5197 8348 18851978348
长沙博诺新材料科技有限公司18191076804 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
12 records
Compound notes
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