Cyclohexylboronic Acid Pinacol Ester - CAS 87100-15-0

Catalog:	BB038251
Product Name:	Cyclohexylboronic Acid Pinacol Ester
CAS:	87100-15-0
Synonyms:	2-cyclohexyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-cyclohexyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-cyclohexyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Description:	Cyclohexylboronic Acid Pinacol Ester (CAS# 87100-15-0) is a useful research chemical.
Molecular Weight:	210.12
Molecular Formula:	C12H23O2B
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2CCCCC2
InChI:	InChI=1S/C12H23BO2/c1-11(2)12(3,4)15-13(14-11)10-8-6-5-7-9-10/h10H,5-9H2,1-4H3
InChI Key:	OUEVCDGYTKLNMJ-UHFFFAOYSA-N
Boiling Point:	244.7 °C at 760 mmHg
Density:	0.93 g/cm³
Appearance:	Liquid
MDL:	MFCD04038749
LogP:	3.41290

Publication Number	Title	Priority Date
CN-112645971-A	Method for directly preparing alkyl borate compound from alkyl halide	20210120
CN-112552323-A	Preparation method of alkyl boride	20201216
CN-112552323-B	Preparation method of alkyl boride	20201216
EP-3764434-A1	Elimination of voltage-delays and stabilisation of impedance through electrolyte additives in alkaline metal chemical cells	20190710
US-2020388885-A1	Silicon-based energy storage devices with lipo2f2 salt-containing electrolyte formulations	20190605

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Related Functional Groups

Boronic Acids and Esters

[766549-26-2]
2-Chloro-4-hydroxyphenylboronic Acid
[470478-90-1]
4-(4-Boc-piperazino)phenylboronic Acid Pinacol Ester
[937796-06-0]
4-(3,5-Dimethyl-1-pyrazolyl)phenylboronic Acid Pinacol Ester
[1171897-39-4]
5-(Boc-amino)pyridine-3-boronic Acid Pinacol Ester
[1256358-61-8]
3-[(2-Methoxyethoxy)methyl]phenylboronic Acid
[2246646-61-5]
2-(3-((4-Bromo-2-chlorophenoxy)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	216
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	210.1791101
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	210.1791101
Rotatable Bond Count:	1
Topological Polar Surface Area:	18.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0