1,2-Dimethylpropyl ethanoate

Modify Date: 2025-08-20 19:46:28

1,2-Dimethylpropyl ethanoate Structure
1,2-Dimethylpropyl ethanoate structure
 Common Name 1,2-Dimethylpropyl ethanoate
CAS Number 5343-96-4 Molecular Weight 130.18500
Density 1.32g/cm3 Boiling Point 122.397ºC at 760 mmHg
Molecular Formula C7H14O2 Melting Point N/A
MSDS N/A Flash Point 17.595ºC

 Names

Name 3-methylbutan-2-yl acetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.32g/cm3
Boiling Point 122.397ºC at 760 mmHg
Molecular Formula C7H14O2
Molecular Weight 130.18500
Flash Point 17.595ºC
Exact Mass 130.09900
PSA 26.30000
LogP 1.59400
Index of Refraction 1.642
InChIKey ZLSXRPTWWRGMTJ-UHFFFAOYSA-N
SMILES CC(=O)OC(C)C(C)C

 Safety Information

HS Code 2915390090

 Synthetic Route

UNII:93FF0F303R structure

UNII:93FF0F303R

CAS#:598-75-4

Ethanoic anhydride structure

Ethanoic anhydride

CAS#:108-24-7

~91%

1,2-Dimethylpropyl ethanoate Structure

1,2-Dimethylpro...

CAS#:5343-96-4

Literature: Hatzakis, Nikos S.; Smonou, Ioulia Bioorganic Chemistry, 2005 , vol. 33, # 4 p. 325 - 337
2-Methylbut-2-ene structure

2-Methylbut-2-ene

CAS#:513-35-9

acetic acid structure

acetic acid

CAS#:64-19-7

~78%

1,2-Dimethylpropyl ethanoate Structure

1,2-Dimethylpro...

CAS#:5343-96-4

Literature: Perkowski, Andrew J.; Nicewicz, David A. Journal of the American Chemical Society, 2013 , vol. 135, # 28 p. 10334 - 10337
4-Methyl-2-pentanone structure

4-Methyl-2-pentanone

CAS#:108-10-1

~%

1,2-Dimethylpropyl ethanoate Structure

1,2-Dimethylpro...

CAS#:5343-96-4

Literature: Yang, Zhi-Wang; Niu, Leng-Yuan; Jia, Xiao-Jie; Kang, Qiao-Xiang; Ma, Zhen-Hong; Lei, Zi-Qiang Catalysis Communications, 2011 , vol. 12, # 9 p. 798 - 802
UNII:93FF0F303R structure

UNII:93FF0F303R

CAS#:598-75-4

Acetyl chloride structure

Acetyl chloride

CAS#:75-36-5

~%

1,2-Dimethylpropyl ethanoate Structure

1,2-Dimethylpro...

CAS#:5343-96-4

Literature: Sarel; Newman Journal of the American Chemical Society, 1956 , vol. 78, p. 5416,5418
acetic acid-d structure

acetic acid-d

CAS#:758-12-3

N/A structure

N/A

CAS#:90886-07-0

~%

2-Methylbut-2-ene structure

2-Methylbut-2-ene

CAS#:513-35-9

1-Propanol,2,2-dimethyl-, 1-acetate structure

1-Propanol,2,2-...

CAS#:926-41-0

Detail
Literature: Katritzky, Alan R.; Dega-Szafran, Zofia; Lopez-Rodriguez, Maria L.; King, Roy W. Journal of the American Chemical Society, 1984 , vol. 106, # 19 p. 5577 - 5585
(2H4)Acetic acid structure

(2H4)Acetic acid

CAS#:1186-52-3

N/A structure

N/A

CAS#:90886-07-0

~%

2-Methylbut-2-ene structure

2-Methylbut-2-ene

CAS#:513-35-9

1-Propanol,2,2-dimethyl-, 1-acetate structure

1-Propanol,2,2-...

CAS#:926-41-0

Detail
Literature: Katritzky, Alan R.; Dega-Szafran, Zofia; Lopez-Rodriguez, Maria L.; King, Roy W. Journal of the American Chemical Society, 1984 , vol. 106, # 19 p. 5577 - 5585
acetyl 2,3-dimethylbutyryl peroxide structure

acetyl 2,3-dime...

CAS#:76085-62-6

~5%

1,2-Dimethylpropyl ethanoate Structure

1,2-Dimethylpro...

CAS#:5343-96-4

acetyl 1,2-dimethylpropyl carbonate structure

acetyl 1,2-dime...

CAS#:76085-66-0

acetic acid structure

acetic acid

CAS#:64-19-7

Literature: Stankevich, A. I.; Zyat'kov, I. P.; Lazareva, A. M.; El'nitskii, A. P. Journal of Organic Chemistry USSR (English Translation), 1980 , vol. 16, p. 1543 - 1548 Zhurnal Organicheskoi Khimii, 1980 , vol. 16, # 9 p. 1823 - 1829
acetic acid structure

acetic acid

CAS#:64-19-7

N/A structure

N/A

CAS#:90886-07-0

~%

2-Methylbut-2-ene structure

2-Methylbut-2-ene

CAS#:513-35-9

1-Propanol,2,2-dimethyl-, 1-acetate structure

1-Propanol,2,2-...

CAS#:926-41-0

Detail
Literature: Katritzky, Alan R.; Dega-Szafran, Zofia; Lopez-Rodriguez, Maria L.; King, Roy W. Journal of the American Chemical Society, 1984 , vol. 106, # 19 p. 5577 - 5585
N/A structure

N/A

CAS#:97311-81-4

Diethyl fumarate structure

Diethyl fumarate

CAS#:623-91-6

~75%

1,2-Dimethylpropyl ethanoate Structure

1,2-Dimethylpro...

CAS#:5343-96-4

N/A structure

N/A

CAS#:97311-85-8

Literature: Giese, Bernd; Harnisch, Hanna; Luening, Ulrich Chemische Berichte, 1985 , vol. 118, # 4 p. 1345 - 1351

 Customs

HS Code 2915390090
Summary 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%

 Synonyms

3-methyl-2-butanol
1,2-Dimethylpropyl acetate
1,2-Dimethylpropyl ethanoate
2-Butanol,3-methyl-,acetate
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