Basic information
- CAS
1310404-57-9- Standard SMILES
COc1ncc(B2OC(C)(C)C(C)(C)O2)cc1C=O- InChIKey
RJAWLLASOPJJEA-UHFFFAOYSA-N- Molecular formula
- C13H18BNO4
- Average molar mass
- 263.1 g/mol
- Monoisotopic mass
- 263.1328882
Names & identifiers
- Preferred name
- 2-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinaldehyde
- IUPAC
- 2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbaldehyde
- English name
- 5-ForMyl-6-Methoxypyridine-3-boronic acid pinacol ester
- Molecular formula
- C13H18BNO4
- Molecular weight
- 263.1
Names & synonyms
1310404-57-92-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinaldehyde5-Formyl-6-methoxypyridine-3-boronic acid pinacol ester2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbaldehydeMFCD080630523-Pyridinecarboxaldehyde, 2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-SCHEMBL18320617DTXSID50694498AKOS015950197FD10372SY255333DS-016975
Show more names
CS-0189142F6272853-Formyl-2-methoxypyridine-5-boronic acid pinacol ester
Database identifiers
- CAS
1310404-57-9- PubChem CID
- 53398546
- DTXSID
DTXSID50694498
Properties
Computed structural properties
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 332
Physicochemical properties
- Boiling point
- 387.2 · 387.2±42.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 1.59 · 1.59±0.22(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
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
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Suppliers10 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [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
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
南京雅科伦医药科技有限公司025-66096098 3165145969 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [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]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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