Demeclocycline hydrochloride supplier

Name
Demeclocycline hydrochloride
EINECS 200-592-2
CAS No. 64-73-3
Density
Solubility Soluble in water.
Melting Point >245 °C (dec.)
Formula C₂₁H₂₂Cl₂N₂O₈
Boiling Point 795.9 °C at 760 mmHg
Molecular Weight 501.32
Flash Point 435.2 °C
Transport Information
Appearance Yellow solid
Safety 36/37
Risk Codes 43
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Naphthacenecarboxamide,7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-,monohydrochloride (8CI);2-Naphthacenecarboxamide,7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-,monohydrochloride, (4S,4aS,5aS,6S,12aS)- (9CI);2-Naphthacenecarboxamide,7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-,monohydrochloride, [4S-(4a,4aa,5aa,6b,12aa)]-;6-Demethyl-7-chlorotetracyclinehydrochloride;7-Chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-2-naphthacenecarboxamidemonohydrochloride;7-Chloro-6-demethyltetracycline hydrochloride;Clortetrin;Declomycin;Declomycin hydrochloride;Demeclocycline hydrochloride;Demethylchlorotetracycline hydrochloride;Demetraciclina;Detravis;Ledermycinhydrochloride;Meciclin;
PSA 181.62000
LogP 1.76720

Demeclocycline hydrochloride Specification

The Demeclocycline hydrochloride, with the CAS registry number 64-73-3, is also known as Demethylchlortetracycline hydrochloride. It belongs to the product categories of Intermediates & Fine Chemicals; Pharmaceuticals. Its EINECS registry number is 200-592-2. This chemical's molecular formula is C₂₁H₂₂Cl₂N₂O₈ and molecular weight is 501.31398. Its IUPAC name is called (2Z,4S,4αS,5αS,6S,12αS)-2-[amino(hydroxy)methylidene]-7-chloro-4-(dimethylamino)-6,10,11,12α-tetrahydroxy-4α,5,5α,6-tetrahydro-4H-tetracene-1,3,12-trione hydrochloride. This chemical's classification codes are Antibacterial; Drug / Therapeutic Agent; Human Data; Reproductive Effect. Demeclocycline hydrochloride is an antibiotic related to tetracycline and produced by streptomyces aureofaciens. Because it is excreted more slowly than tetracycline, it maintains effective blood levels for longer periods of time.

Physical properties of Demeclocycline hydrochloride: (1)# of Rule of 5 Violations: 3; (2)ACD/LogD (pH 5.5): -4; (3)ACD/LogD (pH 7.4): -4; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 10; (9)#H bond donors: 7; (10)#Freely Rotating Bonds: 7; (11)Flash Point: 435.2 °C; (12)Enthalpy of Vaporization: 121.39 kJ/mol; (13)Boiling Point: 795.9 °C at 760 mmHg; (14)Vapour Pressure: 1.02E-26 mmHg at 25°C.

When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes. It may cause sensitisation by skin contact. Whenever you will contact it, please wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.CN(C)[C@@H]1C(\O)=C(\C(N)=O)C(=O)[C@@]2(O)C(/O)=C3/C(=O)c4c(O)ccc(Cl)c4[C@@H](O)[C@H]3C[C@@H]12
(2)InChI: InChI=1/C21H21ClN2O8.ClH/c1-24(2)14-7-5-6-10(16(27)12-9(25)4-3-8(22)11(12)15(6)26)18(29)21(7,32)19(30)13(17(14)28)20(23)31;/h3-4,6-7,14-15,25-26,28-29,32H,5H2,1-2H3,(H2,23,31);1H/t6-,7-,14-,15-,21-;/m0./s1
(3)InChIKey: GVSJQNRGSCOSNJ-KBHRXELFBM

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
man	TDLo	oral	69mg/kg/4D-I (69mg/kg)	KIDNEY, URETER, AND BLADDER: RENAL FUNCTION TESTS DEPRESSED KIDNEY, URETER, AND BLADDER: OTHER CHANGES IN URINE COMPOSITION	American Journal of Kidney Diseases. Vol. 5, Pg. 270, 1985.
mouse	LD50	intravenous	275mg/kg (275mg/kg)		Archivio Italiano di Scienze Mediche Tropical e di Parassitologia. Italian Archives of the Science of Tropical Medicine and Parasitology. Vol. 43, Pg. 143, 1962.
mouse	LD50	oral	2150mg/kg (2150mg/kg)		Drugs in Japan Vol. -, Pg. 704, 1990.
rat	LD50	intravenous	94mg/kg (94mg/kg)		Drugs in Japan Vol. -, Pg. 704, 1990.
rat	LD50	oral	2372mg/kg (2372mg/kg)		Toxicology and Applied Pharmacology. Vol. 18, Pg. 185, 1971.

Product Name

Demeclocycline hydrochloride

Demeclocycline hydrochloride Specification

Related Products

Hot Products