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1-Bromo-2-cyclohexylethane

1-Bromo-2-cyclohexylethane - CAS 1647-26-3

Catalog:	BB012140
Product Name:	1-Bromo-2-cyclohexylethane
CAS:	1647-26-3
Synonyms:	2-bromoethylcyclohexane

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2-bromoethylcyclohexane
Description:	1-Bromo-2-cyclohexylethane (CAS# 1647-26-3) is a reagent used in the cross-coupling and Grignard reactions. It is used in the synthesis of immunosuppressive agents consisting of 5-phenylalkoxypsoralens as well as agonists for human vitamin-D resistant Rickets.
Molecular Weight:	191.11
Molecular Formula:	C8H15Br
Canonical SMILES:	C1CCC(CC1)CCBr
InChI:	InChI=1S/C8H15Br/c9-7-6-8-4-2-1-3-5-8/h8H,1-7H2
InChI Key:	JRQAAYVLPPGEHT-UHFFFAOYSA-N
Boiling Point:	209 ℃
Density:	1.215 g/cm³
Appearance:	Colourless to yellow liquid
MDL:	MFCD00019398
LogP:	3.35170

Publication Number	Title	Priority Date
CN-113372335-A	Phenylalanine derivative containing 1,2, 4-triazole thioether and preparation method and application thereof	20210705
CN-112645971-A	Method for directly preparing alkyl borate compound from alkyl halide	20210120
CN-112375027-A	Indolesulfonamide derivative and medical application thereof	20201207
CN-112300147-A	Pyridine compound, preparation method and application thereof, and pharmaceutical composition	20201119
CN-111056945-A	Photoresist resin monomer synthesized from spiro [5.5] undecane-3, 9-dione and synthesis method thereof	20191225

PMID	Publication Date	Title	Journal
21878004	20120101	Identification of volatile organic compounds in flowers of Astragalus lagopoides	Natural product research

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Related Functional Groups

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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:	65
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.03571
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	190.03571
Rotatable Bond Count:	2
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.1