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Ethyl 4-(2-{4,5-bis[4-(ethoxycarbonyl)phenyl]-1,3-dithiol-2-ylidene}-5-[4-(ethoxycarbonyl)phenyl]-1,3-dithiol-4-yl)benzoate | CAS No. 1356336-61-2

Ethyl 4-(2-{4,5-bis[4-(ethoxycarbonyl)phenyl]-1,3-dithiol-2-ylidene}-5-[4-(ethoxycarbonyl)phenyl]-1,3-dithiol-4-yl)benzoate

Basic Information

Chemical_Structure_Of

CAS Number

1356336-61-2

Molecular Formula

C42H36O8S4

Molecular Weight

796.99 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

CCOC(=O)C1=CC=C(C=C1)C2=C(SC(=C3SC(=C(S3)C4=CC=C(C=C4)C(=O)OCC)C5=CC=C(C=C5)C(=O)OCC)S2)C6=CC=C(C=C6)C(=O)OCC

InChI

InChI=1S/C42H36O8S4/c1-5-47-37(43)29-17-9-25(10-18-29)33-34(26-11-19-30(20-12-26)38(44)48-6-2)52-41(51-33)42-53-35(27-13-21-31(22-14-27)39(45)49-7-3)36(54-42)28-15-23-32(24-16-28)40(46)50-8-4/h9-24H,5-8H2,1-4H3

InChIKey

PGZGHZXUDIFZQV-UHFFFAOYSA-N

LogP

10.83179999999999

Topological Polar Surface Area

105.20000000000003 Å²

Hydrogen Bond Donor/Acceptor

0 / 8

Synonyms & References

English

Tetraethyl 4,4’,4’’,4’’’-[[2,2’-Bi(1,3-dithiolylidene)]-4,4’,5,5’-tetrayl]tetrabenzoate
Benzoic acid, 4,4'-[2-[4,5-bis[4-(ethoxycarbonyl)phenyl]-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-diyl]bis-, 1,1'-diethyl ester

MDL Number

MFCD31630426

Related Compounds

1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

1,3-Dibromo-2,4-dichloro-5-fluorobenzene

CAS Number: 1000573-45-4

Molecular Formula: C6HFCl2Br2

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine

CAS Number: 103687-96-3

Molecular Formula: C17H19NO5S

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine

CAS Number: 112897-99-1

Molecular Formula: C30H31N3O7

Darunavir-d9 structure

Darunavir-d9

CAS Number: 1133378-37-6

Molecular Formula: C27H28D9N3O7S

2-Bromo-3-isopropoxypyridine structure

2-Bromo-3-isopropoxypyridine

CAS Number: 113503-65-4

Molecular Formula: C8H10BrNO

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate structure

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate

CAS Number: 116543-91-0

Molecular Formula: C11H7FO4

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile

CAS Number: 121055-10-5

Molecular Formula: C17H17NO4

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate

CAS Number: 1263059-26-2

Molecular Formula: C8H6ClN3O2

8-Bromoisoquinolin-1-amine structure

8-Bromoisoquinolin-1-amine

CAS Number: 1337879-85-2

Molecular Formula: C9H7BrN2

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Supplier Information

ShangHaiMaiKeLinShengHuaKeJi Inc

CAS Number: 1356336-61-2

Shanghai Jieshukai Biotechnology Co., Ltd.

CAS Number: 1356336-61-2

Shanghai Hansi Chemical Co., Ltd.

CAS Number: 1356336-61-2

Shanghai Yuyeh Biotechnology Co., Ltd.

CAS Number: 1356336-61-2