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2-(1-Chloro-2-phenylethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

HCID 13465331
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Basic information

CAS
94242-82-7
Standard SMILES
CC1(C)OB(C(Cl)Cc2ccccc2)OC1(C)C
InChIKey
XASQMYUOXSIRSR-UHFFFAOYSA-N
Molecular formula
C14H20BClO2
Average molar mass
266.57 g/mol
Monoisotopic mass
266.1244877

Names & identifiers

Preferred name
2-(1-Chloro-2-phenylethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC
2-(1-chloro-2-phenylethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Names & synonyms

94242-82-72-(1-chloro-2-phenylethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneDTXSID70541531RefChem:249726DTXCID70492317SCHEMBL2123752

Database identifiers

CAS
94242-82-7
PubChem CID
13465331
DTXSID
DTXSID70541531

Properties

Computed structural properties

Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
272

Related reactions

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Compound notes

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