ChemicalBook--->CAS DataBase List--->21145-77-7

21145-77-7

21145-77-7 Structure

21145-77-7 Structure
IdentificationBack Directory
[Name]

6-ACETYL-1,1,2,4,4,7-HEXAMETHYLTETRALIN
[CAS]

21145-77-7
[Synonyms]

AHTN
Tonalid
TONALIDE
FIXOLIDE
Ganolide
Tetralide
Extralide
NSC 19550
Ai3-28517
Ccris 8496
Musk tonalid
TONALID(R) II
AHMT (perfume)
Einecs 244-240-6
acetyl methyl tetramethyl tetralin
6-ACETYL-1,1,2,4,4,7-HEXAMETHYLTETRALIN
6-acetyl-1,1,2,4,4,7-hexamethyltetraline
7-acetyl-1,1,3,4,4,6-hexamethyltetraline
1-(3,5,5,6,8,8-Hexamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)
1,2,3,4-Tetrahydro-1,1,3,4,4,6-hexamethyl-7-naphthyl methyl ketone
1-(5,6,7,8-TETRAHYDRO-3,5,5,6,8,8-HEXAMETHYL-2-NAPTHALENYL)ETHANONE
1-(5,6,7,8-tetrahydro-3,5,5,6,8,8-hexamethyl-2-naphthyl)ethan-1-one
1-(3,5,5,6,8,8-Hexamethyl-5,6,7,8-tetrahydro-2-naphthalenyl)ethanone
1-(5,6,7,8-tetrahydro-3,5,5,6,8,8-hexamethyl-2-naphthalenyl)-Ethanone
5',6',7',8'-Tetrahydro-3',5',5',6',8',8'-hexamethyl-2'-acetonaphthone
1-(3,5,5,6,8,8-HexaMethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-ethanone
2'-Acetonaphthone, 5',6',7',8'-tetrahydro-3',5',5',6',8',8'-hexamethyl-
1-(3,5,5,6,8,8-hexaMethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one
1-(5,6,7,8-TETRAHYDRO-3,5,5,6,8,8-HEXAMETHYL-2-NAPHTALENYL)-ETHAN-1-ONE
[EINECS(EC#)]

244-240-6
[Molecular Formula]

C18H26O
[MDL Number]

MFCD00437355
[MOL File]

21145-77-7.mol
[Molecular Weight]

258.4
Chemical PropertiesBack Directory
[Appearance]

Off-White Powder
[Melting point ]

550C
[Boiling point ]

124 °C(Press: 1 Torr)
[density ]

0.919±0.06 g/cm3(Predicted)
[vapor pressure ]

0.068Pa at 25℃
[storage temp. ]

Refrigerator
[solubility ]

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

Solid
[color ]

White to Off-White
[Odor]

musky, warm, radiant, tenacious odor
[Henry's Law Constant]

7.0×10-2 mol/(m3Pa) at 25℃, HSDB (2015)
[Major Application]

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
[Cosmetics Ingredients Functions]

PERFUMING
FRAGRANCE
[InChI]

1S/C18H26O/c1-11-8-16-15(9-14(11)13(3)19)17(4,5)10-12(2)18(16,6)7/h8-9,12H,10H2,1-7H3
[InChIKey]

DNRJTBAOUJJKDY-UHFFFAOYSA-N
[SMILES]

CC1CC(C)(C)c2cc(C(C)=O)c(C)cc2C1(C)C
[LogP]

5.4 at 25℃
[CAS DataBase Reference]

21145-77-7
[NIST Chemistry Reference]

Ethanone, 1-(5,6,7,8-tetrahydro-3,5,5,6,8,8-hexamethyl-2-naphthalenyl)-(21145-77-7)
[EPA Substance Registry System]

Ethanone, 1-(5,6,7,8-tetrahydro-3,5, 5,6,8,8-hexamethyl-2-naphthalenyl)- (21145-77-7)
Hazard InformationBack Directory
[Chemical Properties]

Off-White Powder
[Uses]

Used for non-alcoholic perfumes
[Hazard]

A poison by ingestion. Low toxicity by skin contact.
[Definition]

ChEBI:2-Acetyl-3,5,5,6,8,8-hexamethyl-5,6,7,8- tetrahydronaphthalene is a member of tetralins.
[Flammability and Explosibility]

Nonflammable
[Synthesis]

The synthesis of 6-Acetyl-1,1,2,4,4,7-hexamethyltetralin (Tonalid) includes the following steps:

1. Cyclization

In a 250 ml three-necked flask fitted with electric stirring, a constant pressure dropping funnel and a thermometer, 40 g of anh

Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P301+P312+P330
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

3
[RTECS ]

KM5805024
[TSCA ]

TSCA listed
[REACH Registrations]

Inactive
[Storage Class]

11 - Combustible Solids
[Hazardous Substances Data]

21145-77-7(Hazardous Substances Data)
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