3-[(Dimethylamino)methyl]-5-methyl-2-hexanone

Modify Date: 2024-01-04 12:33:08

3-[(Dimethylamino)methyl]-5-methyl-2-hexanone Structure
3-[(Dimethylamino)methyl]-5-methyl-2-hexanone structure
Common Name 3-[(Dimethylamino)methyl]-5-methyl-2-hexanone
CAS Number 91342-74-4 Molecular Weight 171.280
Density 0.9±0.1 g/cm3 Boiling Point 219.5±23.0 °C at 760 mmHg
Molecular Formula C10H21NO Melting Point 220 ℃
MSDS N/A Flash Point 60.7±13.7 °C

 Names

Name 3-[(dimethylamino)methyl]-5-methylhexan-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.9±0.1 g/cm3
Boiling Point 219.5±23.0 °C at 760 mmHg
Melting Point 220 ℃
Molecular Formula C10H21NO
Molecular Weight 171.280
Flash Point 60.7±13.7 °C
Exact Mass 171.162308
PSA 20.31000
LogP 1.75
Vapour Pressure 0.1±0.4 mmHg at 25°C
Index of Refraction 1.437
Storage condition 2-8°C

 Safety Information

Hazard Codes Xi
HS Code 2922399090

 Synthetic Route

~58%

3-[(Dimethylamino)methyl]-5-methyl-2-hexanone Structure

3-[(Dimethylami...

CAS#:91342-74-4

Literature: AUSPEX PHARMACEUTICAL ,INC.; GANT, Thomas, G.; SHAHBAZ, Manoucherhr Patent: WO2010/44981 A2, 2010 ; Location in patent: Page/Page column 28 ;

~46%

3-[(Dimethylamino)methyl]-5-methyl-2-hexanone Structure

3-[(Dimethylami...

CAS#:91342-74-4

Literature: AUSPEX PHARMACEUTICAL, INC.; GANT, Thomas, G.; ZHANG, Chengzhi; SHAHBAZ, Manouchehr Patent: WO2011/153157 A2, 2011 ; Location in patent: Page/Page column 44 ; WO 2011/153157 A2

~%

3-[(Dimethylamino)methyl]-5-methyl-2-hexanone Structure

3-[(Dimethylami...

CAS#:91342-74-4

Literature: Liu, Chunyi; Chen, Zhengping; Li, Xiaomin; Tang, Jie; Qin, Xiaofeng Chirality, 2013 , vol. 25, # 4 p. 215 - 223

~50%

3-[(Dimethylamino)methyl]-5-methyl-2-hexanone Structure

3-[(Dimethylami...

CAS#:91342-74-4

Literature: Yu, Qian-Sheng; Luo, Weiming; Deschamps, Jeffery; Holloway, Harold W.; Kopajtic, Theresa; Katz, Jonathan L.; Brossi, Arnold; Greig, Nigel H. ACS Medicinal Chemistry Letters, 2010 , vol. 1, # 3 p. 105 - 109

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Detail
Literature: Rhee, Sung-Whi; Ryan, Kenneth J.; Tanga, Mary J. Journal of Labelled Compounds and Radiopharmaceuticals, 2011 , vol. 54, # 7 p. 367 - 370

 Customs

HS Code 2922399090
Summary 2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

2-Hexanone, 3-[(dimethylamino)methyl]-5-methyl-
3-[(Dimethylamino)methyl]-5-methyl-2-hexanone
3-(N,N-dimethylaminomethyl)-5-methyl-2-hexanone
3-dimethylaminomethyl-5-methyl-hexan-2-one