2-ethyl-1-morpholin-4-yl-hexan-1-one

Modify Date: 2025-09-12 18:58:33

2-ethyl-1-morpholin-4-yl-hexan-1-one Structure
2-ethyl-1-morpholin-4-yl-hexan-1-one structure
 Common Name 2-ethyl-1-morpholin-4-yl-hexan-1-one
CAS Number 79868-48-7 Molecular Weight 213.31700
Density 0.973g/cm3 Boiling Point 336.4ºC at 760 mmHg
Molecular Formula C12H23NO2 Melting Point N/A
MSDS N/A Flash Point 157.3ºC

 Names

Name 2-ethyl-1-morpholin-4-ylhexan-1-one

 Chemical & Physical Properties

Density 0.973g/cm3
Boiling Point 336.4ºC at 760 mmHg
Molecular Formula C12H23NO2
Molecular Weight 213.31700
Flash Point 157.3ºC
Exact Mass 213.17300
PSA 29.54000
LogP 1.99950
Index of Refraction 1.464
InChIKey WJNJRMDHLZDCJH-UHFFFAOYSA-N
SMILES CCCCC(CC)C(=O)N1CCOCC1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QE4086000
CHEMICAL NAME :
Morpholine, 4-(2-ethylhexanoyl)-
CAS REGISTRY NUMBER :
79868-48-7
BEILSTEIN REFERENCE NO. :
0144074
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C12-H23-N-O2
MOLECULAR WEIGHT :
213.36
WISWESSER LINE NOTATION :
T6N DOTJ AVY4&2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
450 mg/kg
TOXIC EFFECTS :
Behavioral - sleep
REFERENCE :
JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 30,180,1941
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#09103

 Synthetic Route

morpholine structure

morpholine

CAS#:110-91-8

Hexanal, 2-ethyl- structure

Hexanal, 2-ethyl-

CAS#:123-05-7

~61%

2-ethyl-1-morpholin-4-yl-hexan-1-one Structure

2-ethyl-1-morph...

CAS#:79868-48-7

Literature: Tamaru, Yoshinao; Yamada, Yoshimi; Yoshida, Zen-ichi Synthesis, 1983 , # 6 p. 474 - 476

 Precursor & DownStream

Precursor  2

DownStream  0

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