Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester

Modify Date: 2024-01-06 19:49:53

Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester Structure
Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester structure
 Common Name Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester
CAS Number 7425-14-1 Molecular Weight 256.42400
Density 0.863 g/cm3 Boiling Point 288.3ºC at 760 mmHg
Molecular Formula C16H32O2 Melting Point N/A
MSDS N/A Flash Point 137.1ºC

 Names

Name 2-ethylhexyl 2-ethylhexanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.863 g/cm3
Boiling Point 288.3ºC at 760 mmHg
Molecular Formula C16H32O2
Molecular Weight 256.42400
Flash Point 137.1ºC
Exact Mass 256.24000
PSA 26.30000
LogP 4.96240
Index of Refraction 1.437

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MO7750000
CHEMICAL NAME :
Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester
CAS REGISTRY NUMBER :
7425-14-1
BEILSTEIN REFERENCE NO. :
1777190
LAST UPDATED :
199701
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C16-H32-O2
MOLECULAR WEIGHT :
256.48
WISWESSER LINE NOTATION :
4Y2&VO1Y4&2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Open irritation test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 23,95,1962
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
AJOPAA American Journal of Ophthalmology. (Ophthalmic Pub. Co., 435 N. Michigan Ave., Suite 1415, Chicago, IL 60611) Series 3: V.1- 1918- Volume(issue)/page/year: 29,1363,1946
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,367,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
27 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 23,95,1962
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>20 mL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 23,95,1962

 Synthetic Route

Hexanal, 2-ethyl- structure

Hexanal, 2-ethyl-

CAS#:123-05-7

~94%

Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester Structure

Hexanoic acid, ...

CAS#:7425-14-1
Literature: Ogoshi, Sensuke; Hoshimoto, Yoichi; Ohashi, Masato Chemical Communications, 2010 , vol. 46, # 19 p. 3354 - 3356
2-Ethylhexanol structure

2-Ethylhexanol

CAS#:104-76-7

~92%

Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester Structure

Hexanoic acid, ...

CAS#:7425-14-1
Literature: Liu, Xiuhong; Wu, Jun; Shang, Zhicai Synthetic Communications, 2012 , vol. 42, # 1 p. 75 - 83
2-Ethylhexanol structure

2-Ethylhexanol

CAS#:104-76-7

~9%

Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester Structure

Hexanoic acid, ...

CAS#:7425-14-1

2-ethylhexanoyl fluoride structure

2-ethylhexanoyl...

CAS#:156150-09-3
Literature: Rozen, Shlomo; Ben-David, Iris Journal of Fluorine Chemistry, 1996 , vol. 76, # 2 p. 145 - 147
2-Ethylhexanol structure

2-Ethylhexanol

CAS#:104-76-7

~%

Hexanal, 2-ethyl- structure

Hexanal, 2-ethyl-

CAS#:123-05-7
2-Ethylcaproic acid structure

2-Ethylcaproic acid

CAS#:149-57-5
Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester Structure

Hexanoic acid, ...

CAS#:7425-14-1
Literature: Ghiaci; Kalbasi; Sedaghat Organic Process Research and Development, 2003 , vol. 7, # 6 p. 936 - 938
2-Ethylhexanol structure

2-Ethylhexanol

CAS#:104-76-7

~15%

2-Ethylcaproic acid structure

2-Ethylcaproic acid

CAS#:149-57-5
Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester Structure

Hexanoic acid, ...

CAS#:7425-14-1
Literature: Mohandas, T. P.; Mamman, Ajit, S.; Nair, P. Madhavan Tetrahedron, 1983 , vol. 39, # 7 p. 1187 - 1188
Hexanal, 2-ethyl- structure

Hexanal, 2-ethyl-

CAS#:123-05-7
Aluminium isopropoxide structure

Aluminium isopr...

CAS#:555-31-7

~%

Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester Structure

Hexanoic acid, ...

CAS#:7425-14-1
Literature: Kulpinski; Nord Journal of Organic Chemistry, 1943 , vol. 8, p. 260,268 Nature (London, United Kingdom), 1943 , vol. 151, p. 363
Hexanal, 2-ethyl- structure

Hexanal, 2-ethyl-

CAS#:123-05-7

~%

2-Ethylhexanol structure

2-Ethylhexanol

CAS#:104-76-7
2-Ethylcaproic acid structure

2-Ethylcaproic acid

CAS#:149-57-5
Hexanoic acid, 2-ethyl-, 2-ethylhexyl ester Structure

Hexanoic acid, ...

CAS#:7425-14-1
Literature: Haeusermann Helvetica Chimica Acta, 1951 , vol. 34, p. 2172,2179

 Synonyms

2-Ethylhexylester kyseliny 2-ethylkapronove [Czech]
nBuCH(Et)COOCH2CH(Et)nBu
2-Aethyl-hexansaeure-(2-aethyl-hexylester)
2-Ethylhexyl-2-ethylhexanoate
HEXANOIC ACID,2-ETHYL-,2-ETHYLHEXYL ESTER
2-Ethylhexanoic acid,2-ethylhexyl ester
EINECS 231-057-1
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