Basic information
- CAS
1992904-49-0- Standard SMILES
CC(C)(C)OC(=O)c1nc(Cl)ccc1N- InChIKey
QANFRDUSAIEFPS-UHFFFAOYSA-N- Molecular formula
- C10H13ClN2O2
- Average molar mass
- 228.67 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 3-amino-6-chloro-pyridine-2-carboxylate
- IUPAC
- tert-butyl 3-amino-6-chloropyridine-2-carboxylate
- English name
- 2-Pyridinecarboxylic acid, 3-amino-6-chloro-, 1,1-dimethylethyl ester
- Molecular formula
- C10H13ClN2O2
- Molecular weight
- 228.68
Names & synonyms
1992904-49-0tert-butyl 3-amino-6-chloro-pyridine-2-carboxylateMFCD34566915tert-Butyl 3-amino-6-chloropicolinatetert-butyl 3-amino-6-chloropyridine-2-carboxylateSCHEMBL27837947SCHEMBL303224402-Pyridinecarboxylic acid, 3-amino-6-chloro-, 1,1-dimethylethyl esterAKOS015836634AT29045PS-19457SY323566
Show more names
EN300-6508574tert-butyl 3-amino-6-chloro-pyridine-2-carboxylate - [B84459]
Database identifiers
- CAS
1992904-49-0
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 240
Physicochemical properties
- Boiling point
- 374.9 · 374.9±37.0 °C(Predicted)
- Density
- 1.24 · 1.240±0.06 g/cm3(Predicted)
- pka
- 0.08 · 0.08±0.10(Predicted)
Chemistry & industry
Suppliers8 total
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
南京药石科技股份有限公司025-86918202 4000255188 · [email protected]
西安凯新生物科技有限公司029-68881181 13619217766 · [email protected]
南京后秀医药科技有限公司15252458249 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
誉通医药科技（苏州）有限公司0512-15851462628 15851462628 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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