58888-90-7

58888-90-7 structure
58888-90-7 structure
  • Name: 3-butylheptanoic acid
  • Chemical Name: 3-butylheptanoic acid
  • CAS Number: 58888-90-7
  • Molecular Formula: C11H22O2
  • Molecular Weight: 186.29100
  • Create Date: 2016-07-25 18:31:46
  • Modify Date: 2024-01-13 20:40:43

Name 3-butylheptanoic acid
Synonyms 3-n-Butyl-heptansaeure
Heptanoic acid,3-butyl
Acide dibutylpropionique
3-Butylheptanoicacid
3-n-Butyl-heptancarbonsaeure
Density 0.908g/cm3
Boiling Point 289.3ºC at 760 mmHg
Molecular Formula C11H22O2
Molecular Weight 186.29100
Flash Point 154.2ºC
Exact Mass 186.16200
PSA 37.30000
LogP 3.45770
Index of Refraction 1.444

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MJ1931000
CHEMICAL NAME :
Heptanoic acid, 3-butyl-
CAS REGISTRY NUMBER :
58888-90-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H22-O2
MOLECULAR WEIGHT :
186.33

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 10,453,1975

~88%

58888-90-7 structure

58888-90-7

Literature: Cooke, Manning P. Journal of Organic Chemistry, 1986 , vol. 51, # 9 p. 1637 - 1638

~%

58888-90-7 structure

58888-90-7

Literature: Malthete, Jacques; Canceill, Josette; Gabard, Jacqueline; Jacques, Jean Tetrahedron, 1981 , vol. 37, # 16 p. 2823 - 2828

~%

58888-90-7 structure

58888-90-7

Literature: Malthete, Jacques; Canceill, Josette; Gabard, Jacqueline; Jacques, Jean Tetrahedron, 1981 , vol. 37, # 16 p. 2823 - 2828

~%

58888-90-7 structure

58888-90-7

Literature: Cooke, Manning P. Journal of Organic Chemistry, 1986 , vol. 51, # 9 p. 1637 - 1638

~%

58888-90-7 structure

58888-90-7

Literature: Malthete, Jacques; Canceill, Josette; Gabard, Jacqueline; Jacques, Jean Tetrahedron, 1981 , vol. 37, # 16 p. 2823 - 2828

~%

58888-90-7 structure

58888-90-7

Literature: Cooke, Manning P. Journal of Organic Chemistry, 1987 , vol. 52, # 26 p. 5729 - 5733

~%

58888-90-7 structure

58888-90-7

Literature: Cooke, Manning P. Journal of Organic Chemistry, 1987 , vol. 52, # 26 p. 5729 - 5733

~%

58888-90-7 structure

58888-90-7

Literature: Taillandier; Benoit Guyod; Boucherle; et al. European Journal of Medicinal Chemistry, 1975 , vol. 10, # 5 p. 453 - 462