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111128-27-9

111128-27-9 structure

111128-27-9 structure

Name: (2Z,8E,10E)-heptadeca-2,8,10-trien-4,6-diyne-1,14-diol
Chemical Name: (2Z,8E,10E)-heptadeca-2,8,10-trien-4,6-diyne-1,14-diol
CAS Number: 111128-27-9
Molecular Formula: C₁₇H₂₂O₂
Molecular Weight: 258.35500
Create Date: 2018-04-12 08:00:00
Modify Date: 2025-08-25 18:39:17

Name	(2Z,8E,10E)-heptadeca-2,8,10-trien-4,6-diyne-1,14-diol
Synonyms	14-Hydroxy-bupleurynol (+)-Heptadeca-2t,8t,10t-trien-4,6-diin-1,14-diol,Oenanthotoxin (+)-Heptadeca-2t,8t,10t-trien-4,6-diin-1,14-diol Oenanthotoxin (+)-heptadeca-2t,8t,10t-triene-4,6-diyne-1,14-diol 2,8,10-HEPTADECATRIENE-4,6-DIYNE-1,14-DIOL,(Z,E,E) Bupleurotoxin

Density	1.025g/cm3
Boiling Point	458.7ºC at 760mmHg
Molecular Formula	C₁₇H₂₂O₂
Molecular Weight	258.35500
Flash Point	213.8ºC
Exact Mass	258.16200
PSA	40.46000
LogP	2.59530
Vapour Pressure	2.42E-10mmHg at 25°C
Index of Refraction	1.547

CHEMICAL IDENTIFICATION

RTECS NUMBER :: MI3930000

CHEMICAL NAME :: 2,8,10-Heptadecatriene-4,6-diyne-1,14-diol, (Z,E,E)-

CAS REGISTRY NUMBER :: 111128-27-9

LAST UPDATED :: 198812

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C17-H22-O2

MOLECULAR WEIGHT :: 258.39

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 3030 ug/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: YHHPAL Yaoxue Xuebao. Acta Pharmaceutica Sinica. Pharmaceutical Journal. (China International Book Trading Corp., POB 2820, Beijing, Peop. Rep. China) V.1- 1953- Suspended 1966-78. Volume(issue)/page/year: 22,507,1987

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