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2-(4-Ethylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

HCID 45786359
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1425335-82-5
Standard SMILES
CCc1csc(B2OC(C)(C)C(C)(C)O2)c1
InChIKey
WFCZVPRHFJHOHF-UHFFFAOYSA-N
Molecular formula
C12H19BO2S
Average molar mass
238.16 g/mol
Monoisotopic mass
238.1198812

Names & identifiers

Preferred name
2-(4-Ethylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC
2-(4-ethylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
English name
4-Ethylthiophene-2-boronic acid pinacol ester
Molecular formula
C12H19BO2S
Molecular weight
238.15

Names & synonyms

1425335-82-52-(4-ethylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane1,3,2-Dioxaborolane, 2-(4-ethyl-2-thienyl)-4,4,5,5-tetramethyl-SCHEMBL21052188WLZ3128DTXSID201173953AKOS015943604CS-310644-Ethylthiophene-2-boronic acid pinacol ester2-(4-Ethyl-2-thienyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Database identifiers

CAS
1425335-82-5
PubChem CID
45786359
DTXSID
DTXSID201173953
EC Number
161-481-1

Properties

Computed structural properties

Topological polar surface area
46.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
252

Physicochemical properties

Boiling point
325 · 325.0±30.0 °C(Predicted)
Density
1.04 · 1.04±0.1 g/cm3(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

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 · 4 items

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%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers6 total

浙江雅辰药物科技股份有限公司13674959855 13674959855 · [email protected]
康姆芘法思(上海)生物科技有限公司021-65232103 17602124823 · [email protected]
康姆芘法思(上海)生物科技有限公司021-65232103 17602124823 · [email protected]
济南鑫宏泰化学有限公司13000000000 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

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Compound notes

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