2-(5-Cyclopropylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Basic information
- CAS
1979157-06-6- Standard SMILES
CC1(C)OB(c2ccc(C3CC3)s2)OC1(C)C- InChIKey
GGFYXFSRHYPEQE-UHFFFAOYSA-N- Molecular formula
- C13H19BO2S
- Average molar mass
- 250.2 g/mol
- Monoisotopic mass
- 250.1198812
Names & identifiers
- Preferred name
- 2-(5-Cyclopropylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- IUPAC
- 2-(5-cyclopropylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Names & synonyms
1979157-06-62-(5-cyclopropylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneRefChem:458799858-932-6SCHEMBL17967053AKOS015943599CS-31353EN300-3694255-(Cyclopropyl)thiophene-2-boronic acid pinacol esterZ2049747442
Database identifiers
- CAS
1979157-06-6- PubChem CID
- 45786336
- EC Number
- 858-932-6
Properties
Computed structural properties
- Topological polar surface area
- 46.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 299
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
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Related reactions
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Compound notes
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