ChemicalBook--->CAS DataBase List--->51755-66-9

51755-66-9

51755-66-9 Structure

51755-66-9 Structure
IdentificationMore
[Name]

3-(Methylthio)-1-hexanol
[CAS]

51755-66-9
[Synonyms]

3-METHYLMERCAPTO-1-HEXANOL
3-(METHYLMERCAPTO)HEXANOL
3-(METHYLTHIO)-1-HEXANOL
3-(METHYLTHIO)HEXAN-1-OL
3-(METHYLTHIO)HEXANOL
FEMA 3438
3-(methylthio)-1-hexano
3-(METHYLTHIO)-1-HEXANOL 97+%
1-Hexanol, 3-(methylthio)-
3-METHYLTHIO-1-HEXANOL NATURAL
3-Methylsulfanylhexan-1-ol
[EINECS(EC#)]

257-380-8
[Molecular Formula]

C7H16OS
[MDL Number]

MFCD00010674
[Molecular Weight]

148.27
[MOL File]

51755-66-9.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR SLIGHTLY YELLOW LIQUID
[Boiling point ]

61-62 °C10 mm Hg(lit.)
[density ]

0.966 g/mL at 25 °C(lit.)
[FEMA ]

3438
[refractive index ]

n20/D 1.4759(lit.)
[Fp ]

226 °F
[pka]

14.90±0.10(Predicted)
[Odor]

at 0.10 % in propylene glycol. sulfurous metallic green leafy vegetable
[biological source]

synthetic
[Odor Type]

sulfurous
[JECFA Number]

463
[Major Application]

flavors and fragrances
[InChI]

InChI=1S/C7H16OS/c1-3-4-7(9-2)5-6-8/h7-8H,3-6H2,1-2H3
[InChIKey]

JSASXSHMJYRPCM-UHFFFAOYSA-N
[SMILES]

C(O)CC(SC)CCC
[LogP]

1.81
[CAS DataBase Reference]

51755-66-9(CAS DataBase Reference)
[NIST Chemistry Reference]

3-Methylthio-1-hexanol(51755-66-9)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P304+P340+P312-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 .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

UN 3334
[WGK Germany ]

3
[HazardClass ]

9
[HS Code ]

29309099
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-(Methylthio)-1-hexanol(51755-66-9).msds
Hazard InformationBack Directory
[Description]

3-(Methylthio)-l-hexanol has a green, vegetable odor.
[Chemical Properties]

3-Methylthio-1-hexanol has a sulfurous onion, garlic green, vegetable odor.
[Chemical Properties]

CLEAR SLIGHTLY YELLOW LIQUID
[Occurrence]

Reported found in passion fruit and jackfrui
[Uses]

3-(Methylthio)-1-hexanol may be used in chemical synthesis.
[Aroma threshold values]

Aroma characteristics at 1.0%: sulfurous, metallic and pungent with a slight spicy, green leafy, wasabi-like and vegetative note with an earthy nuance
[Taste threshold values]

Taste characteristics at 0.25 to 10 ppm: metallic, sulfurous with a green vegetative and slight spicy nuance.
[Biochem/physiol Actions]

Taste at 0.25-10 ppm
Spectrum DetailBack Directory
[Spectrum Detail]

3-(Methylthio)-1-hexanol(51755-66-9)1HNMR
3-(Methylthio)-1-hexanol(51755-66-9)IR
3-(Methylthio)-1-hexanol(51755-66-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-(Methylthio)-1-hexanol, 97%(51755-66-9)
[Alfa Aesar]

3-(Methylthio)hexanol, 99%(51755-66-9)
[Sigma Aldrich]

51755-66-9(sigmaaldrich)
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