beta-Cyclogeraniol-d5

Base Information

Chemical Name:beta-Cyclogeraniol-d5
CAS No.:78995-99-0
Molecular Formula:C10H13D5O
Molecular Weight:154.25
Hs Code.:
DSSTox Substance ID:DTXSID80486727
Mol file:78995-99-0.mol

Synonyms:78995-99-0;beta-Cyclogeraniol-d5;[3,3-dideuterio-6,6-dimethyl-2-(trideuteriomethyl)cyclohexen-1-yl]methanol;b-Cyclogeraniol-D5;?-Cyclogeraniol-d5;beta -Cyclogeraniol-d5;DTXSID80486727;[6,6-Dimethyl-2-(~2~H_3_)methyl(3,3-~2~H_2_)cyclohex-1-en-1-yl]methanol

Suppliers and Price of beta-Cyclogeraniol-d5

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
b-Cyclogeraniol-d5
1mg
$ 425.00

TRC
β-Cyclogeraniol-d5
1mg
$ 140.00

TRC
β-Cyclogeraniol-d5
10mg
$ 1100.00

Medical Isotopes, Inc.
β-Cyclogeraniol-d5
1 mg
$ 650.00

American Custom Chemicals Corporation
BETA-CYCLOGERANIOL-D5 95.00%
5MG
$ 503.81

Total 4 raw suppliers

Chemical Property of beta-Cyclogeraniol-d5

Chemical Property:

Vapor Pressure:0.045mmHg at 25°C
Boiling Point:209.827°C at 760 mmHg
Flash Point:88.142°C
PSA：20.23000
Density:0.922g/cm³
LogP:2.50530
Solubility.:Chloroform, Dichloromethane, Ethyl Acetate,
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:159.167148923
Heavy Atom Count:11
Complexity:177

Purity/Quality:

95% atom D ^*data from raw suppliers

b-Cyclogeraniol-d5 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(CCC1)(C)C)CO
Isomeric SMILES:[2H]C1(CCC(C(=C1C([2H])([2H])[2H])CO)(C)C)[2H]
Uses β-Cyclogeraniol-d5 (cas# 78995-99-0) is a compound useful in organic synthesis.

Technology Process of beta-Cyclogeraniol-d5

There total 3 articles about beta-Cyclogeraniol-d5 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 78995-98-9
pentadeuterio-β-cyclocitral

: 78995-99-0
6,6-dimethyl-1-(hydroxymethyl)-2-(methyl-d3)-1-cyclohexene-3,3-d2

Guidance literature:: With 9-borabicyclo[3.3.1]nonane dimer; ethanolamine; Yield given. Multistep reaction; 1.) THF, RT, 24 h, 2.) ether, a) RT, 80 min, b) -5 deg C, 1.5 h;
DOI:10.1021/jm00142a018

Reference yield:

: 14505-74-9,41721-03-3,59462-59-8,432-24-6
α-cyclocitral

: 78995-99-0
6,6-dimethyl-1-(hydroxymethyl)-2-(methyl-d3)-1-cyclohexene-3,3-d2

Guidance literature:: Multi-step reaction with 2 steps

1: 4.7 g / MeOH-d, Na / 250 h

2: 1.) 9-borabicyclo<3.3.1>nonane (9-BBN), 2.) 2-aminoethanol / 1.) THF, RT, 24 h, 2.) ether, a) RT, 80 min, b) -5 deg C, 1.5 h

With 9-borabicyclo[3.3.1]nonane dimer; deuteromethanol; sodium; ethanolamine;
DOI:10.1021/jm00142a018

Reference yield:

: 78995-99-0
6,6-dimethyl-1-(hydroxymethyl)-2-(methyl-d3)-1-cyclohexene-3,3-d2

: C₁₀H₁₃⁽²⁾H₅O

Guidance literature:: With sodium tetrahydroborate; Yield given. Multistep reaction. Yields of byproduct given. Title compound not separated from byproducts; 1.) deuteration, 2.) CH₃OD, 0 deg C, 1h;
DOI:10.1002/hlca.19850680503