(-)-Citronellol

Base Information Edit

Chemical Name:(-)-Citronellol
CAS No.:7540-51-4
Molecular Formula:C10H20O
Molecular Weight:156.268
Hs Code.:29052220
European Community (EC) Number:231-415-7
UNII:8RSY5Y5658
DSSTox Substance ID:DTXSID1041550
Nikkaji Number:J67.958E
Wikidata:Q27105229
RXCUI:2050062
Metabolomics Workbench ID:28011
ChEMBL ID:CHEMBL1907995
Mol file:7540-51-4.mol

Synonyms:7540-51-4;(S)-3,7-dimethyloct-6-en-1-ol;(-)-beta-Citronellol;l-Citronellol;(-)-Citronellol;(S)-(-)-citronellol;beta-Rhodinol;(3S)-3,7-dimethyloct-6-en-1-ol;(S)-(-)-beta-Citronellol;(S)-citronellol;6-Octen-1-ol, 3,7-dimethyl-, (3S)-;(-)-3,7-Dimethyloct-6-en-1-ol;(S)-(-)-3,7-Dimethyl-6-octen-1-ol;(3S)-citronellol;6-Octen-1-ol, 3,7-dimethyl-, (S)-;(S)-3,7-Dimethyl-6-octen-1-ol;CHEBI:88;UNII-8RSY5Y5658;3S,7-dimethyloct-6-en-1-ol;DTXSID1041550;8RSY5Y5658;EINECS 231-415-7;FEMA No. 2309;6-Octen-1-ol, 3,7-dimethyl-, (-)-;AI3-09552;MFCD00063214;(3s)-3,7-dimethyl-6-octen-1-ol;(S)-(-)-beta-Citronellol, 99%, FG;laevo-citronellol;(S) -citronellol;(s)-beta-citronellol;(-)-fA-Citronellol;(-)-(s)-citronellol;CITRONELLOL, L-;beta-Citronellol, (S)-;(-)-(S)-beta-citronellol;SCHEMBL301394;CHEMBL1907995;DTXCID9021550;(-)-.BETA.-CITRONELLOL;.BETA.-CITRONELLOL, (S)-;Tox21_300711;(S)-(-)-beta-Citronellol, 99%;AKOS015902396;(S)-(-)-.BETA.-CITRONELLOL;CS-W016231;LMPR0102010012;LS-2078;NCGC00248147-01;NCGC00254618-01;AC-26774;AS-57118;(-)-beta-Citronellol, analytical standard;CAS-7540-51-4;C2254;C3619;F16553;Q27105229;( - ) - 3,7 - dimethyloct - 6 - en - 1 - ol

Suppliers and Price of (-)-Citronellol

Supply Marketing:Edit

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

TRC
L-Citronellol
100g
$ 130.00

TCI Chemical
(-)-β-Citronellol min. 98.0 %
25ML
$ 81.00

TCI Chemical
(-)-β-Citronellol
5ML
$ 27.00

TCI Chemical
(-)-beta-Citronellol >95.0%(GC)
25mL
$ 65.00

Sigma-Aldrich
(S)-(?)-β-Citronellol 99%,FG
1 SAMPLE-K
$ 50.00

Sigma-Aldrich
(?)-β-Citronellol 99%, FG
sample-k
$ 50.00

Sigma-Aldrich
(S)-(?)-β-Citronellol 99%
1g
$ 46.70

Sigma-Aldrich
(S)-(?)-β-Citronellol 99%, FG
sample
$ 40.00

Sigma-Aldrich
(S)-(?)-β-Citronellol 99%, FG
100 g
$ 163.00

Sigma-Aldrich
(?)-β-Citronellol 99%, FG
100g-k
$ 163.00

Total 102 raw suppliers

Chemical Property of (-)-Citronellol Edit

Chemical Property:

Appearance/Colour:Clear colorless liquid
Vapor Pressure:~0.02 mm Hg ( 25 °C)
Melting Point:77-83oC(lit.)
Refractive Index:n20/D 1.456
Boiling Point:224.5 °C at 760 mmHg
PKA:15.13±0.10(Predicted)
Flash Point:98.3 °C
PSA：20.23000
Density:0.845 g/cm³
LogP:2.75130
Storage Temp.:2-8°C
Solubility.:Chloroform (Soluble), Ethyl Acetate (Slightly), Methanol (Soluble)
Water Solubility.:SLIGHTLY SOLUBLE
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:156.151415257
Heavy Atom Count:11
Complexity:112

Purity/Quality:

99.9% ^*data from raw suppliers

L-Citronellol ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(CCC=C(C)C)CCO
Isomeric SMILES:C[C@@H](CCC=C(C)C)CCO
Uses L-Citronellol as fragrance ingredient.

Technology Process of (-)-Citronellol

There total 43 articles about (-)-Citronellol 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: 99.0%

: 106-24-1
Geraniol

: 7540-51-4
(S)-3,7-dimethyl-6-octen-1-ol

Guidance literature:: With bis(norbornadiene)rhodium(l)tetrafluoroborate; (R_C,S_Fc,S_P)-1-[2-(1-N,N-dimethylaminoethyl)ferrocen-1-yl]phenylphosphino-1'-dicyclohexylphosphinoferrocene; hydrogen; In dichloromethane; at 20 ℃; for 20h; under 19001.3 Torr; enantioselective reaction; Inert atmosphere; Autoclave;
DOI:10.1039/c3cc47727d

Reference yield: 98.59%

: 141-27-5,96680-15-8
3,7-dimethyl-2,6-octadienal

: 7540-51-4
(S)-3,7-dimethyl-6-octen-1-ol

Guidance literature:: With dichloro(1,5-cyclooctadiene)ruthenium(II); (R)-(+)-2,2',6,6'-tetramethoxy-4,4'-bis(diphenylphosphino)-3,3'-bipyridine; niobium pentachloride; HSiPh₃; In toluene; at 40 ℃; for 3h; Reagent/catalyst; Solvent; Temperature; enantioselective reaction; Catalytic behavior; Glovebox; Sealed tube; Inert atmosphere;