(-)-Irofulven

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Names

[ Name ]:
(-)-Irofulven

[Synonym ]:
HMAF
Spiro(cyclopropane-1,5'(5H)-inden)-7'(6'H)-one,6'-hydroxy-3'-(hydroxymethyl)-2',4',6'-trimethyl-,(R)
[14C]-Irofulven
6-hydroxymethylacylfulvene
(-)-irofulven
Acylfulvene,6-(hydroxymethyl)
MGI 114

Chemical & Physical Properties

[ Density]:
1.28g/cm3

[ Boiling Point ]:
501ºC at 760 mmHg

[ Molecular Formula ]:
C₁₅H₁₈O₃

[ Molecular Weight ]:
246.30200

[ Flash Point ]:
270.9ºC

[ Exact Mass ]:
246.12600

[ PSA ]:
57.53000

[ LogP ]:
1.66560

[ Vapour Pressure ]:
3.9E-12mmHg at 25°C

[ Index of Refraction ]:
1.617

[ Storage condition ]:
-20°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: WH0204487

CHEMICAL NAME :: Spiro(cyclopropane-1,5'(5H)-inden)-7'(6'H)-one, 6'-hydroxy-3'-(hydroxymethyl)-2',4',6'- trimethyl-, (R)-

CAS REGISTRY NUMBER :: 158440-71-2

LAST UPDATED :: 199712

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C15-H18-O3

MOLECULAR WEIGHT :: 246.33

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >6610 ug/kg

TOXIC EFFECTS :: Cardiac - other changes Blood - changes in bone marrow (not otherwise specified) Blood - changes in other cell count (unspecified)

REFERENCE :: FAATDF Fundamental and Applied Toxicology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1981- Volume(issue)/page/year: 36(1, Pt 2),180,1997

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Mammal - dog

DOSE/DURATION :: 2 mg/kg

TOXIC EFFECTS :: Blood - thrombocytopenia Blood - changes in bone marrow (not otherwise specified) Blood - changes in other cell count (unspecified)

REFERENCE :: FAATDF Fundamental and Applied Toxicology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1981- Volume(issue)/page/year: 36(1, Pt 2),180,1997 ** OTHER MULTIPLE DOSE TOXICITY DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 20339 ug/kg/5D-I

TOXIC EFFECTS :: Cardiac - other changes Blood - changes in bone marrow (not otherwise specified) Blood - changes in other cell count (unspecified)

REFERENCE :: FAATDF Fundamental and Applied Toxicology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1981- Volume(issue)/page/year: 36(1, Pt 2),180,1997

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Mammal - dog

DOSE/DURATION :: 3 mg/kg/5D-I

TOXIC EFFECTS :: Blood - thrombocytopenia Blood - changes in bone marrow (not otherwise specified) Blood - changes in other cell count (unspecified)

REFERENCE :: FAATDF Fundamental and Applied Toxicology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1981- Volume(issue)/page/year: 36(1, Pt 2),180,1997

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Formaldehyde
acylfulvene
Illudin S

DownStream

Related Compounds

rac-Irofulven
2-(2-(aminomethyl)piperidin-1-yl)-1-(1H-pyrrol-2-yl)ethanone hydrochloride
benzyl 5-hydroxytetrahydro-2H-pyran-3-ylcarbamate
2-(1-benzyl-1H-1,2,3-triazol-4-yl)benzonitrile
(1-((3-Nitropyridin-2-yl)sulfonyl)piperidin-2-yl)methanamine hydrochloride
N-((6-(Pyrrolidin-2-yl)-4-(trifluoromethyl)pyridin-3-yl)methyl)acetamide dihydrochloride
2-[(Pyrrolidin-3-yl)methyl]-1,3-thiazole
3-Azetidin-3-yl-1-methyl-1H-pyrazolo[3,4-b]pyridinetetra(trifluoroacetic acid salt)
1-[(3-fluoro-4-methoxyphenyl)methyl]-3-phenyl-1H,2H,3H,4H-thieno[3,2-d]pyrimidine-2,4-dione
1-[(4-ethenylphenyl)methyl]-3-(2-fluorophenyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidine-2,4-dione
2-((1-(Trifluoromethyl)piperidin-3-yl)methoxy)ethanol

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