Basic information
- CAS
1980783-96-7- Standard SMILES
COC(=O)c1c(Cl)cccc1B1OC(C)(C)C(C)(C)O1- InChIKey
GUMXBRZEDJLNNF-UHFFFAOYSA-N- Molecular formula
- C14H18BClO4
- Average molar mass
- 296.55 g/mol
- Monoisotopic mass
- 296.0986669
Names & identifiers
- Preferred name
- Methyl 2-chloro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)benzoate
- IUPAC
- methyl 2-chloro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
- English name
- 2-Chloro-6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzoic acid methyl ester
- Molecular formula
- C14H18BClO4
- Molecular weight
- 296.55
Names & synonyms
1980783-96-73-Chloro-2-methoxycarbonylphenylboronic acid, pinacol esterMETHYL 2-CHLORO-6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOATE2-Chloro-6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzoic acid methyl esterMFCD16996246SCHEMBL17981663FED78396MB20300DB-096211CS-0189391C91615EN300-12611153
Show more names
methyl 2-chloro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan- 2-yl)benzoateBenzoic acid, 2-chloro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
F627518A1-03472Z3247245845methyl 2-chloro-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoateMETHYL2-CHLORO-6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOATE
Database identifiers
- CAS
1980783-96-7- PubChem CID
- 72221119
Properties
Computed structural properties
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 369
Physicochemical properties
- Boiling point
- 395.9 · 395.9±32.0 °C(Predicted)
- Density
- 1.17 · 1.17±0.1 g/cm3(Predicted)
- storage temp.
- Store at Room Tem.
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 303 · H303-H320
- Precautionary statements
- 312 · P312-P264-P305+P351+P338-P337+P313
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
- H303-H320
- Precautionary statements
- P312-P264-P305+P351+P338-P337+P313
Chemistry & industry
Suppliers8 total
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
南京代盟化工有限公司02566880956 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [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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