Anhydrotetracycline hydrochloride
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Anhydrotetracycline hydrochloride
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CAS No:
13803-65-1
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Formula:
C22H22N2O7.ClH
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Chemical Name:
Anhydrotetracycline hydrochloride
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Synonyms:
2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-,hydrochloride (1:1),(4S,4aS,12aS)-;2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-,monohydrochloride;2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-,monohydrochloride,[4S-(4α,4aα,12aα)]-;2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-,monohydrochloride,(4S,4aS,12aS)-;Anhydrotetracycline hydrochloride;101812-44-6
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CAS No:
Characteristics
161
1.95810
Yellow to bright yellow Powder
214 °C (decomp)
618.6ºC at 760 mmHg
327.9ºC
Soluble in ethanol, DMSO, or DMF
Refrigerator
3.66E-16mmHg at 25°C
Safety Information
NONH for all modes of transport
3
63-36
36/37/39-26
QI7860000
Xn
P201, P202, P261, P264, P270, P271, P280, P281, P301+P310, P302+P352, P304+P340, P305+P351+P338, P308+P313, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501
H301
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P280, P281, P301+P310, P302+P352, P304+P340, P305+P351+P338, P308+P313, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Anhydrotetracycline hydrochloride Use and Manufacturing
Anhydrotetracycline hydrochloride is a salt of a degradation product of tetracycline, formed by dehydration at the C6 position under acidic conditions to aromatise the B ring. Anhydrotetracycline is an important standard for monitoring tetracycline stability. Although the degradation is associated with a loss of antibiotic activity, anhydrotetracycline is considered biologically active and is thought responsible for aspects of tetracycline toxicity.
Computed Properties
Molecular Weight:462.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:462.1193788
Monoisotopic Mass:462.1193788
Topological Polar Surface Area:161
Heavy Atom Count:32
Complexity:855
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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Anhydrotetracycline hydrochloride
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