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Hycanthone mesylate

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Name

Hycanthone mesylate

EINECS 245-527-9
CAS No. 23255-93-8 Density g/cm3
PSA 117.46000 LogP 4.36630
Solubility moderate

Stability

    Stable, but light sensitive. Decomposes rapidly in the presence of acid.

Toxicology

    Harmful if swallowed. Experimental carcinogen, teratogen, tumorigen.

    Toxici

Melting Point ca. 143 C
Formula C20H24N2O2S•CH4O3S Boiling Point 570.5°Cat760mmHg
Molecular Weight 452.63 Flash Point 298.9°C
Transport Information N/A Appearance yellow to orange powder
Safety A poison by intraperitoneal, subcutaneous, intravenous, and intramuscular routes. Moderately toxic by ingestion. Questionable carcinogen with experimental carcinogenic, tumorigenic, and teratogenic data. Other experimental reproductive effects. Human systemic effects by intramuscular route: hallucinations, muscle weakness, nausea or vomiting. Human mutation data reported. When heated to decomposition it emits very toxic fumes of SOx. See also SULFONATES. Risk Codes N/A
Molecular Structure Molecular Structure of 23255-93-8 (N-[2-(diethylamino)ethyl]-4-methoxy-9-oxoxanthene-1-amine monomethanesulphonate) Hazard Symbols N/A
Synonyms

Etrenol;1-(2-diethylaminoethylamino)-4-(hydroxymethyl)thioxanthen-9-one; methanesulfonic acid;HCT;1-((2-(DIETHYLAMINO)ETHYL)AMINO)-4-(HYDROXY-METHYL)-9H-THIOXANTHEN-9-ONE MONOMETHANE-SULFONATE (SALT);Thioxanthen-9-one, 1-((2-(diethylamino)ethyl)amino)-4-(hydroxymethyl)-, monomethanesulfonate (salt) (8CI);9H-Thioxanthen-9-one, 1-[[2- (diethylamino)ethyl]amino]-4-(hydroxymethyl)-, monomethanesulfonate (salt);Thioxanthen-9-one, 1-[[2- (diethylamino)ethyl]amino]-4-(hydroxymethyl)-, monomethanesulfonate (salt);1-((2-(DIETHYLAMINO)ETHYL)AMINO)-4-(HYDROXYMET*);N-(2-(Diethylamino)ethyl)-4-methoxy-9-oxoxanthene-1-amine monomethanesulphonate;Hycanthone monomethanesulphonate;Hycanthone methanesulphonate;Hycanthone mesylate;9H-Thioxanthen-9-one, 1-((2-(diethylamino)ethyl)amino)-4-(hydroxymethyl)-, monomethanesulfonate (salt);diethyl-[2-[[4-(hydroxymethyl)-9-oxo-thioxanthen-1-yl]amino]ethyl]azanium; methanesulfonate;9H-Thioxanthen-9-one,1-[[2-(diethylamino)- ethyl]amino]-4-(hydroxymethyl)-,monomethanesulfonate (salt);Hycanthone monomethanesulfonate;Hycanthone methanesulfonate (VAN);Hycanthone methane sulfate;

 

Hycanthone mesylate Chemical Properties

Molecular Structure of Hycanthone mesylate (CAS NO. 23255-93-8):

IUPAC Name: Diethyl-[2-[[4-(hydroxymethyl)-9-oxothioxanthen-1-yl]amino]ethyl]azanium; methanesulfonate  
Molecular Formula: C21H28N2O5S2
Molecular Weight: 452.587420 g/mol
H-Bond Donor: 3
H-Bond Acceptor: 6
Canonical SMILES: CC[NH+](CC)CCNC1=C2C(=C(C=C1)CO)SC3=CC=CC=C3C2=O.CS(=O)(=O)[O-]
InChI: InChI=1S/C20H24N2O2S.CH4O3S/c1-3-22(4-2)12-11-21-16-10-9-14(13-23)20-18(16)19(24)15-7-5-6-8-17(15)25-20;1-5(2,3)4/h5-10,21,23H,3-4,11-13H2,1-2H3;1H3,(H,2,3,4)
InChIKey: LOEQGPPJCCUXEJ-UHFFFAOYSA-N
Flash Point: 298.9 °C
Enthalpy of Vaporization: 90.02 kJ/mol
Boiling Point: 570.5 °C at 760 mmHg
Vapour Pressure: 7.42E-14 mmHg at 25 °C
Sensitive of Hycanthone mesylate (CAS NO. 23255-93-8): Light

Hycanthone mesylate Toxicity Data With Reference

1.    

dnr-esc 16 µg/well

    ENMUDM    Environmental Mutagenesis. 3 (1981),429.
2.    

cyt-hmn:leu 1 µmol/L

    MUREAV    Mutation Research. 21 (1973),287.
3.    

cyt-hmn:lym 2400 µg/L

    JTEHD6    Journal of Toxicology and Environmental Health. 1 (1976),211.
4.    

dni-hmn:lym 50 mg/L

    BCPCA6    Biochemical Pharmacology. 22 (1973),1253.
5.    

sln-dmg-par 4400 µmol/L

    MUREAV    Mutation Research. 82 (1981),111.
6.    

sln-dmg-orl 4400 µmol/L

    MUREAV    Mutation Research. 82 (1981),111.
7.    

otr-rat-ipr 30 mg/kg

    CNREA8    Cancer Research. 40 (1980),1157.
8.    

ipr-mus TDLo:815 mg/kg/33W-I:CAR

    IJCNAW    International Journal of Cancer. 23 (1979),97.
9.    

ims-hmn TDLo:3 mg/kg:CNS,GIT

    PACHAS    Pure and Applied Chemistry. 42 (1975),209.
10.    

ipr-rat LDLo:100 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 187 (1973),437.
11.    

orl-mus LD50:565 mg/kg

Hycanthone mesylate Consensus Reports

IARC Cancer Review: Group 3 IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 7 , 1987,p. 56.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Inadequate Evidence IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 13 , 1977,p. 91.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) . EPA Genetic Toxicology Program.

Hycanthone mesylate Safety Profile

A poison by intraperitoneal, subcutaneous, intravenous, and intramuscular routes. Moderately toxic by ingestion. Questionable carcinogen with experimental carcinogenic, tumorigenic, and teratogenic data. Other experimental reproductive effects. Human systemic effects by intramuscular route: hallucinations, muscle weakness, nausea or vomiting. Human mutation data reported. When heated to decomposition it emits very toxic fumes of SOx. See also SULFONATES.

Hycanthone mesylate Specification

  Hycanthone mesylate with cas registry number of 23255-93-8 is also called for AI3-61987 ; CCRIS 333 ; Etrenol ; HSDB 7094 ; Hycanthone methanesulfonate ; Hycanthone methanesulfonate (VAN) ; Hycanthone methanesulphonate ; Hycanthone monomethanesulfonate ; Hycanthone monomethanesulphonate ; 9H-Thioxanthen-9-one, 1-((2-(diethylamino)ethyl)amino)-4-(hydroxymethyl)-, monomethanesulfonate (salt) ; N-(2-(Diethylamino)ethyl)-4-methoxy-9-oxoxanthene-1-amine monomethanesulphonate ; Thioxanthen-9-one, 1-((2-(diethylamino)ethyl)amino)-4-(hydroxymethyl)-, monomethanesulfonate (salt) (8CI) . It is odorless yellow to yellow-orange powder with bitter taste.

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