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(4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride | CAS No. 10118-90-8

(4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride

Basic Information

Chemical_Structure_Of
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CAS Number

10118-90-8

Molecular Formula

C23H27N3O7

Molecular Weight

457.48 g/mol

AD

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids
Basic Chemical Raw Materials Organic Chemicals Ketones
Basic Chemical Raw Materials Organic Chemicals Amines
Fine Chemicals Dyes and Pigments Organic Dyes
Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

563.31°C (rough estimate)

Refractive Index

1.6500 (estimate)

Specific Rotation

D25 -166° (c = 0.524)

SMILES

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CN(C)C1C2CC3CC4=C(C=CC(=C4C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O)N(C)C

InChI

InChI=1S/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,17,27,29-30,33H,7-8H2,1-4H3,(H2,24,32)/t9-,11-,17-,23-/m0/s1

InChIKey

DYKFCLLONBREIL-KVUCHLLUSA-N

LogP

0.18660000000000165

Topological Polar Surface Area

164.63000000000002 Ų

Hydrogen Bond Donor/Acceptor

6 / 10

Complexity

971

Synonyms & References

English

  • 7-Dimethylamino-6-demethyl-6-deoxytetracycline
  • AB00053501_05
  • CL59806
  • (4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-CARBOXAMIDE
  • (4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide
  • SMP1_000191
  • Minocyclin
  • minociclinum
  • Minocycline [USAN:INN:BAN]
  • Minocin
  • minocycline
  • Spectrum2_001047
  • CHEBI:50694
  • CHEMBL1434
  • KBioSS_001447
  • HY-17412A
  • Prestwick2_000315
  • MINOCYCLINE [USAN]
  • Minomycin
  • Minocyclinum
  • 4,7-Bis(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-2-naphthacenecarboxamide
  • NSC141993
  • SCHEMBL4042
  • SBI-0051449.P003
  • AC-30184
  • Tox21_113643
  • Spectrum5_001293
  • 2-NAPHTHACENECARBOXAMIDE, 4,7-BIS(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-, (4S-(4.ALPHA.,4A.ALPHA.,5A.ALPHA.,12A.ALPHA.))-
  • KSC-12-231B
  • TIGECYCLINE IMPURITY C [EP IMPURITY]
  • Minocyclinum [INN-Latin]

MDL Number

MFCD00072105

FAQ

What are the physical and chemical properties of (4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride (CAS: 10118-90-8)?
This compound has a crystalline form and a molecular weight of approximately 615.81 g/mol. It is slightly soluble in water and ethanol. Chemically, it is reactive towards bases and nucleophiles, making it suitable for various synthetic applications. Its solubility and reactivity make it ideal for use in organic synthesis and pharmaceuticals.

How is (4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride (CAS: 10118-90-8) typically synthesized?
This compound is typically synthesized via a multi-step process involving the condensation of a tetracene derivative with dimethylamine, followed by hydroxylation and amidation steps. Key catalysts and reagents include palladium and various oxidants. The process yields high-quality products with good selectivity and yield.

What industries use (4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride (CAS: 10118-90-8)?
This compound is primarily used in pharmaceuticals for its potential as a therapeutic agent, as well as in the polymer and semiconductor industries for its electronic and optical properties. It can also find applications in sensor technology due to its unique reactivity and solubility properties.

What precautions should be taken when handling (4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride (CAS: 10118-90-8)?
Proper handling of this compound requires the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a fume hood to minimize exposure. In case of a spill, immediate containment and cleanup should be performed, and the Material Safety Data Sheet (MSDS) should be consulted for detailed instructions. Handling should be done by trained personnel familiar with the compound's properties and safe handling procedures.

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JiangSuBeiDaYiYao Technology Co Ltd

CAS Number: 10118-90-8

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(4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride — Hubei Yangxin Pharmaceutical Technology Co., Ltd.

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WuHanHongXinKangJingXi Chemical Co Ltd

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(4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride — Taizhou Haimen Pharmaceutical Co., Ltd.

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(4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride — ShangHai PoDianDing Standard Technical Service Co., Ltd.

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(4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride — Shanghai Yuyeh Biotechnology Co., Ltd.

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(4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride — HePeng （ ShangHai ） Biotechnology Co Ltd

HePeng （ ShangHai ） Biotechnology Co Ltd

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(4S,4As,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide dihydrochloride — ShangHaiJiangLaiShiYe Inc

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