ChemicalBook--->CAS DataBase List--->2385-77-5

2385-77-5

2385-77-5 Structure

2385-77-5 Structure
IdentificationMore
[Name]

(+)-CITRONELLAL
[CAS]

2385-77-5
[Synonyms]

(3R)-3,7-DIMETHYL-6-OCTENAL
(+)-CITRONELLAL
(R)-(+)-3,7-DIMETHYL-6-OCTENAL
(R)-(+)-CITRONELLAL
(3R)-(+)-Citronellal
(R)-3,7-dimethyl-oct-6-enal
(R)-3,7-dimethyloct-6-enal
6-Octenal,3,7-dimethyl-,(3R)-
6-Octenal,3,7-dimethyl-,(R)-
7-dimethyl-(theta)-6-octena
D-Citronellal
R-3,7-dimethyl-oct-6-enal
(R)-(+)-CITRONELLAL, TECH., 90%
CITRONELLAL(D-)
(+)-CITRONELLAL 95+%
(+)-Citronellal, (3R)-3,7-Dimethyl-6-octenal
[EINECS(EC#)]

219-194-5
[Molecular Formula]

C10H18O
[MDL Number]

MFCD00067089
[Molecular Weight]

154.25
[MOL File]

2385-77-5.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless liquid
[Melting point ]

25°C
[Boiling point ]

207 °C(lit.)
[density ]

0.851 g/mL at 25 °C(lit.)
[vapor pressure ]

33.9Pa at 25℃
[refractive index ]

n20/D 1.448(lit.)
[Fp ]

185 °F
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Sparingly), Ethyl Acetate (Slightly)
[form ]

Oil
[color ]

Colourless
[Odor]

at 100.00 %. fresh herbal citrus
[Odor Type]

herbal
[Water Solubility ]

88mg/L
[Merck ]

2329
[BRN ]

1720791
[InChI]

1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3/t10-/m1/s1
[InChIKey]

NEHNMFOYXAPHSD-SNVBAGLBSA-N
[SMILES]

C[C@H](CC\C=C(\C)C)CC=O
[LogP]

3.83 at 25℃
[CAS DataBase Reference]

2385-77-5(CAS DataBase Reference)
[EPA Substance Registry System]

6-Octenal, 3,7-dimethyl-, (3R)- (2385-77-5)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[TSCA ]

TSCA listed
[REACH Registrations]

Active
[HS Code ]

2912190090
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

clear colorless liquid
[Uses]

(+)-Citronellal is a monoterpene compound that is formed by the metabolism of plants. (+)-Citronellal is a natural insect repellant, and is the main component of citronellal oil. (+)-Citronellal is also used as a starting material in the one pot synthesis of (-)-Menthol (M218875).
[Uses]

insect repellent
[Definition]

ChEBI: The (3R)-stereoisomer of 3,7-dimethyloct-6-enal (citronellal).
[Flammability and Explosibility]

Nonflammable
[IC 50]

Human Endogenous Metabolite
Spectrum DetailBack Directory
[Spectrum Detail]

(+)-CITRONELLAL(2385-77-5)1HNMR
(+)-CITRONELLAL(2385-77-5)IR
(+)-CITRONELLAL(2385-77-5)FT-IR
(+)-CITRONELLAL(2385-77-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

2385-77-5(sigmaaldrich)
[TCI AMERICA]

(+)-Citronellal,>95.0%(GC)(2385-77-5)
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