Basic information
- CAS
1246184-56-4- Standard SMILES
CC(C)(C)OC(=O)Nc1cc(B2OC(C)(C)C(C)(C)O2)cnc1Cl- InChIKey
GUCJCQYMGIIITM-UHFFFAOYSA-N- Molecular formula
- C16H24BClN2O4
- Average molar mass
- 354.6 g/mol
- Monoisotopic mass
- 354.1517651
Names & identifiers
- Preferred name
- tert-Butyl (2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)carbamate
- IUPAC
- tert-butyl N-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]carbamate
- English name
- 3-TERT-BUTYLOXYCARBONYLAMINO-2-CHLOROPYRIDINE-5-BORONIC ACID PINACOL ESTER
- Molecular formula
- C16H24BClN2O4
- Molecular weight
- 354.64
Names & synonyms
1246184-56-4tert-Butyl (2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)carbamate3-tert-Butyloxycarbonylamino-2-chloropyridine-5-boronic acid pinacol estertert-butyl N-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]carbamateMFCD08063059Carbamic acid, N-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-, 1,1-dimethylethyl estertert-Butyl [2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]carbamateBoc-5-Amino-6-chloropyridine-3-boronic acid pinacol esterSCHEMBL409016DTXSID10694499AKOS015950198FD10437
Show more names
FS-6633SB83749tert-butyl N-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridyl]carbamatetert-Butyl(2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)carbamateDA-13687CS-0175421EN300-7389921F243638
Database identifiers
- CAS
1246184-56-4- PubChem CID
- 53398547
- DTXSID
DTXSID10694499
Properties
Computed structural properties
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 465
Physicochemical properties
- Boiling point
- 417 · 417.0±45.0 °C(Predicted)
- Density
- 1.17 · 1.17±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 12.11 · 12.11±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312+P330-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
- HS Code
- 2933399990 · 2933399990
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
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312+P330-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Suppliers13 total
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海安化生物技术有限公司021-61263375 18168859245
上海贤鼎生物科技有限公司4009209199 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
扬州海昊生物科技有限公司0514-15895751441 15895751441 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
杭州博洛科生物科技有限公司13757158499; 13757158499 · [email protected]
无锡迈默拓普生物科技有限公司15061806929 · [email protected]
上海梦蓝医药科技有限公司13062660007 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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