CAS No.7540-51-4,BETA-RHODINOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	7540-51-4
Name:	BETA-RHODINOL
Article Data:	61

Formula:	C₁₀H₂₀O
Molecular Weight:	156.268
Synonyms:	6-Octen-1-ol,3,7-dimethyl-, (-)- (8CI);6-Octen-1-ol, 3,7-dimethyl-, (S)-;(-)-(S)-Citronellol;(-)-Citronellol;(-)-b-Citronellol;(S)-(-)-Citronellol;(S)-(-)-b-Citronellol;(S)-3,7-Dimethyl-6-octen-1-ol;(S)-Citronellol;(S)-b-Citronellol;L-Citronellol;
EINECS:	231-415-7
Density:	0.845 g/cm³
Melting Point:	77-83oC(lit.)
Boiling Point:	224.5 °C at 760 mmHg
Flash Point:	98.3 °C
Solubility:	SLIGHTLY SOLUBLE
Appearance:	Clear colorless liquid
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	20.23000
LogP:	2.75130

Synthetic route

: 106-24-1
Geraniol

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

Conditions

Conditions	Yield
With bis(norbornadiene)rhodium(l)tetrafluoroborate; (RC,SFc,SP)-1-[2-(1-N,N-dimethylaminoethyl)ferrocen-1-yl]phenylphosphino-1'-dicyclohexylphosphinoferrocene; hydrogen In dichloromethane at 20℃; under 19001.3 Torr; for 20h; Inert atmosphere; Autoclave; enantioselective reaction;	99%
With [RuCl(p-cymene)((R)-Tol-BINAP)]Cl; potassium hydroxide In isopropyl alcohol for 2h; Inert atmosphere; Reflux;	70%
Multi-step reaction with 2 steps 1: in Ficus retusa Linn. 2: in Ficus retusa Linn. nach Injektion View Scheme

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

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

Conditions

Conditions	Yield
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; Catalytic behavior; Reagent/catalyst; Solvent; Temperature; Glovebox; Sealed tube; Inert atmosphere; enantioselective reaction;	98.59%
With (η4-cyclooctadiene)((R)-2,2'-bis(diphenylphosphanyl)-1,1'-binaphthyl)rhodium(I) tetrfluoroborate; hydrogen In methanol at 60℃; under 33753.4 Torr; for 5h; Autoclave; enantioselective reaction;	88%

: Carbonic acid (S)-3,7-dimethyl-oct-6-enyl ester 2,2,2-trichloro-ethyl ester

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

Conditions

Conditions	Yield
With indium; water; ammonium chloride In methanol for 1h; Heating;	98%

: 5949-05-3
(S)-Citronellal

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

Conditions

Conditions	Yield
With lithium aluminium tetrahydride In diethyl ether	96%
With lithium aluminium tetrahydride In diethyl ether	94%
With sodium tetrahydroborate In ethanol at 0℃;	93%

: Trichloro-acetic acid (S)-3,7-dimethyl-oct-6-enyl ester

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

Conditions

Conditions	Yield
With indium; water; ammonium chloride In methanol for 0.5h; Heating;	95%

: (R)-2-(3,7-dimethyloct-6-en-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

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

Conditions

Conditions	Yield
With sodium perborate; water In tetrahydrofuran at 20℃; for 4h; enantioselective reaction;	95%

: 93041-00-0
2,2-dimethyl-propionic acid (3S)-3,7-dimethyl-oct-6-enyl ester

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

Conditions

Conditions	Yield
With sodium hydroxide In methanol Ambient temperature;	94%

: (S)-8-(allyloxy)-2,6-dimethyloct-2-ene

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

Conditions

Conditions	Yield
Stage #1: (S)-8-(allyloxy)-2,6-dimethyloct-2-ene With C12H37NiP4(1+)*C2F6NO4S2(1-) In tetrahydrofuran at 20℃; for 0.5h; Glovebox; Schlenk technique; Inert atmosphere; Stage #2: With toluene-4-sulfonic acid In tetrahydrofuran for 1.5h; Glovebox; Schlenk technique; Reflux; Inert atmosphere;	94%

: 89156-40-1
(S)-3,7-Dimethyl-oct-6-enoic acid (1S,2R,3S,4R)-3-(2,2-dimethyl-propoxy)-4,7,7-trimethyl-bicyclo[2.2.1]hept-2-yl ester

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

B: 85695-96-1
(1R,2S,3R,4S)-2-(2,2-dimethylpropoxy)-1,7,7-trimethylbicyclo<2.2.1>heptan-3-ol

Conditions

Conditions	Yield
With lithium aluminium tetrahydride	A 88% B 81%

: 84237-05-8
(S)-((3,7-dimethyloct-6-enyloxy)methyl)benzene

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

Conditions

Conditions	Yield
With ammonia; lithium In tetrahydrofuran at -30℃; for 0.666667h;	82%

Total:102 Page 1 of 3 1 2 3 Next>>

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Chemistry

Molecular structure of 6-Octen-1-ol, 3,7-dimethyl-, (3S)- (CAS NO.7540-51-4) is:

Product Name: 6-Octen-1-ol, 3,7-dimethyl-, (3S)-
CAS Registry Number: 7540-51-4
IUPAC Name: 3,7-dimethyloct-6-en-1-ol
Molecular Weight: 156.2652 [g/mol]
Molecular Formula: C₁₀H₂₀O
XLogP3-AA: 3.2
H-Bond Donor: 1
H-Bond Acceptor: 1
EINECS: 231-415-7
Surface Tension: 28.5 dyne/cm
Density: 0.845 g/cm³
Flash Point: 98.3 °C
Enthalpy of Vaporization: 53.6 kJ/mol
Boiling Point: 224.5 °C at 760 mmHg
Vapour Pressure: 0.0183 mmHg at 25°C
Vapor pressure: ~0.02 mm Hg ( 25 °C)
Refractive index: n20/D 1.456
Storage temp.: 2-8°C
Product Categories: All Aliphatics ;Acyclic Monoterpenes ;Biochemistry ;Terpenes ;Aliphatics ;Chiral Reagents

Safety Profile

Safty information about 6-Octen-1-ol, 3,7-dimethyl-, (3S)- (CAS NO.7540-51-4) is:
Hazard Codes: Irritant Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 2
F: 8-10

Specification

6-Octen-1-ol, 3,7-dimethyl-, (3S)- , its cas register number is 7540-51-4. It also can be called AI3-09552 ; EINECS 231-415-7 ; FEMA No. 2309 ; beta-Citronellol ; l-Citronellol ; (-)-3,7-Dimethyloct-6-en-1-ol ; 6-Octen-1-ol, 3,7-dimethyl-, (S)- .It is a clear colorless liquid.