5,5-dimethylhexan-3-one

Modify Date: 2025-08-25 16:12:19

5,5-dimethylhexan-3-one Structure
5,5-dimethylhexan-3-one structure
Common Name 5,5-dimethylhexan-3-one
CAS Number 5340-30-7 Molecular Weight 128.21200
Density 0.812g/cm3 Boiling Point 149.9ºC at 760 mmHg
Molecular Formula C8H16O Melting Point N/A
MSDS N/A Flash Point 34.4ºC

 Names

Name 5,5-dimethyl-3-hexanone
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.812g/cm3
Boiling Point 149.9ºC at 760 mmHg
Molecular Formula C8H16O
Molecular Weight 128.21200
Flash Point 34.4ºC
Exact Mass 128.12000
PSA 17.07000
LogP 2.40170
Index of Refraction 1.41
InChIKey BARYVXFFVQIMLI-UHFFFAOYSA-N
SMILES CCC(=O)CC(C)(C)C

 Safety Information

HS Code 2914190090

 Synthetic Route

~45%

5,5-dimethylhexan-3-one Structure

5,5-dimethylhex...

CAS#:5340-30-7

Literature: Binnewirtz, Ralf-Juergen; Klingenberger, Helmut; Welte, Rainer; Paetzold, Peter Chemische Berichte, 1983 , vol. 116, # 4 p. 1271 - 1284

~%

5,5-dimethylhexan-3-one Structure

5,5-dimethylhex...

CAS#:5340-30-7

Literature: Whitmore et al. Journal of the American Chemical Society, 1938 , vol. 60, p. 2789 Journal of the American Chemical Society, 1941 , vol. 63, p. 647

~8%

5,5-dimethylhexan-3-one Structure

5,5-dimethylhex...

CAS#:5340-30-7

Literature: Mello, Rossella; Martinez-Ferrer, Jaime; Alcalde-Aragones, Ana; Varea, Teresa; Acerete, Rafael; Gonzalez-Nunez, Maria Elena; Asensio, Gregorio Journal of Organic Chemistry, 2011 , vol. 76, # 24 p. 10129 - 10139

~%

5,5-dimethylhexan-3-one Structure

5,5-dimethylhex...

CAS#:5340-30-7

Literature: Whitmore; Laughlin Journal of the American Chemical Society, 1933 , vol. 55, p. 3736

~%

5,5-dimethylhexan-3-one Structure

5,5-dimethylhex...

CAS#:5340-30-7

Literature: Heilmann; de Gaudemaris Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1951 , vol. 233, p. 874

~%

5,5-dimethylhexan-3-one Structure

5,5-dimethylhex...

CAS#:5340-30-7

Literature: Whitmore et al. Journal of the American Chemical Society, 1938 , vol. 60, p. 2789 Journal of the American Chemical Society, 1941 , vol. 63, p. 647

~%

Detail
Literature: Whitmore; Forster Journal of the American Chemical Society, 1942 , vol. 64, p. 2967

 Customs

HS Code 2914190090
Summary 2914190090 other acyclic ketones without other oxygen function。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 Synonyms

Ethanimidic acid,N,2-dicyano-,ethyl ester
Aethyl-neopentyl-keton
Ethylneopentylketon
5,5-Dimethyl-hexan-3-on
Ethyl N-cyan-cyanacetylimidat
ethyl-neopentyl-ketone
5,5-Dimethyl-3-hexanon
Ethyl-N-cyano-cyanoacetimidat
5,5-dimethyl-hexan-3-one
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