(3S,6S)-2,7-Dimethyl-3,6-octanediol

Basic Information

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CAS Number

129705-30-2

Molecular Formula

C10H22O2

Molecular Weight

174.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

252 ºC

Flash Point

108 ºC

SMILES

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O[C@@H](CC[C@H](O)C(C)C)C(C)C

InChI

InChI=1S/C10H22O2/c1-7(2)9(11)5-6-10(12)8(3)4/h7-12H,5-6H2,1-4H3/t9-,10-/m0/s1

InChIKey

IIEGQVRKIRPFFP-UWVGGRQHSA-N

LogP

1.8004

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Synonyms & References

English

(3S,6S)-2,7-Dimethyloctane-3,6-diol
(3S,6S)-2,7-Dimethyl-3,6-octanediol
(3S,6S)-3,6-dihydroxy-2,7-dimethyloctane
39277_ALDRICH
39277_FLUKA
50407_FLUKA
AG-D-60326
AK-57244
CTK4B6375

FAQ

What is (3S,6S)-2,7-Dimethyl-3,6-octanediol (CAS: 129705-30-2)?

(3S,6S)-2,7-Dimethyl-3,6-octanediol is a cyclic diol with the molecular formula C8H16O2. It has a sweet, fruity aroma and is used in various applications due to its chemical properties. This compound is commonly found in fragrances, personal care products, and as a food additive.

What are the main uses of (3S,6S)-2,7-Dimethyl-3,6-octanediol (CAS: 129705-30-2)?

(3S,6S)-2,7-Dimethyl-3,6-octanediol is primarily used as a fragrance ingredient in soaps, detergents, and perfumes. It also serves as a food additive, enhancing flavor and aroma in foods and beverages. Additionally, it is used in the research and development of new cosmetic and pharmaceutical products.

Is (3S,6S)-2,7-Dimethyl-3,6-octanediol (CAS: 129705-30-2) safe?

(3S,6S)-2,7-Dimethyl-3,6-octanediol is considered safe for use in cosmetics and food products when used within the limits set by regulatory authorities. Users should avoid contact with eyes and skin, and use proper ventilation during handling. It is important to follow all safety precautions and storage guidelines provided by manufacturers.

How should (3S,6S)-2,7-Dimethyl-3,6-octanediol (CAS: 129705-30-2) be stored?

(3S,6S)-2,7-Dimethyl-3,6-octanediol should be stored in a cool, dark place, away from direct sunlight and heat sources to prevent degradation. It should be kept in a tightly sealed container to maintain its quality. Storage at temperatures below 25°C (77°F) and with a relative humidity below 50% is recommended to ensure long-term stability.