N-[6-[[(1S,3S)-3-(1,2-dihydroxyethyl)-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-oxan-4-yl]-2,2,2-trifluoro-acetamide

Modify Date: 2025-08-25 18:33:10

N-[6-[[(1S,3S)-3-(1,2-dihydroxyethyl)-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-oxan-4-yl]-2,2,2-trifluoro-acetamide structure	Common Name	N-[6-[[(1S,3S)-3-(1,2-dihydroxyethyl)-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-oxan-4-yl]-2,2,2-trifluoro-acetamide
	CAS Number	66512-17-2	Molecular Weight	641.54300
	Density	1.66g/cm3	Boiling Point	872.9ºC at 760 mmHg
	Molecular Formula	C₂₉H₃₀F₃NO₁₂	Melting Point	N/A
	MSDS	N/A	Flash Point	481.7ºC

Name	5,12-Naphthacenedione, 8-(1,2-dihydroxyethyl)-7,8,9,10-tetrahyro-6,8,11-trihydroxy-1-methoxy-10-[[2,3,6-trideoxy-3-[(trifluoroacetyl)amino]-.α.-L-lyxo-hexopyranosyl]oxy]
Synonym	More Synonyms

Density	1.66g/cm3
Boiling Point	872.9ºC at 760 mmHg
Molecular Formula	C₂₉H₃₀F₃NO₁₂
Molecular Weight	641.54300
Flash Point	481.7ºC
Exact Mass	641.17200
PSA	212.31000
LogP	0.90380
Index of Refraction	1.662
InChIKey	TWMWXCYMYAQOTO-YWSIFKHZSA-N
SMILES	COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(O)CO)CC3OC1CC(NC(=O)C(F)(F)F)C(O)C(C)O1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: QI9420000

CHEMICAL NAME :: 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-8-(1,2-dihydroxyethyl)-1-methoxy- 10-((2,3,6- trideoxy-2-(trifluoroacetamido)-alpha-L-lyxo-hexopyra nosyl)oxy)-6,8,11-tri hydroxy-

CAS REGISTRY NUMBER :: 66512-17-2

LAST UPDATED :: 198207

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C29-H30-F3-N-O12

MOLECULAR WEIGHT :: 641.60

WISWESSER LINE NOTATION :: L E6 C666 BV MVT&&&J DQ HYQ1Q HQ KQ RO1 FO- FT6OTJ B1 CQ DMVXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :: DNA damage

TEST SYSTEM :: Rodent - mouse Leukocyte

DOSE/DURATION :: 43700 nmol/L

REFERENCE :: CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 41,1006,1981

N-trifluoroacetyladriamycinol

AD-92

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