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(1,2)Benzisothiazolo(2,3,4-lma)benzo(h)quinoxalino(2,3-c)carbazole-11,16-dione, 9,9-dioxide

HCID 80400
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
6252-73-9
Standard SMILES
O=C1c2ccccc2C(=O)c2c1c1c3nc4ccccc4nc3c3cccc4c3c1n2S4(=O)=O
InChIKey
VAVINMPVFFDRLD-UHFFFAOYSA-N
Molecular formula
C26H11N3O4S
Average molar mass
461.4 g/mol
Monoisotopic mass
461.04702701

Names & identifiers

Preferred name
(1,2)Benzisothiazolo(2,3,4-lma)benzo(h)quinoxalino(2,3-c)carbazole-11,16-dione, 9,9-dioxide
IUPAC
30,30-dioxo-30λ6-thia-1,14,21-triazaoctacyclo[25.2.1.02,11.04,9.012,29.013,22.015,20.023,28]triaconta-2(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tridecaene-3,10-dione
English name
[1,2]benzisothiazolo[2,3,4-lma]benzo[h]quinoxalino[2,3-c]carbazole-11,16-dione 9,9-dioxide
Molecular formula
C26H11N3O4S
Molecular weight
461.456

Names & synonyms

Vat Yellow 276252-73-9DTXSID90211562RefChem:1049190DTXCID20134053(1,2)Benzisothiazolo(2,3,4-lma)benzo(h)quinoxalino(2,3-c)carbazole-11,16-dione, 9,9-dioxide228-376-3(1,2)Benzisothiazolo(2,3,4-lma)benzo(h)quinoxalino(2,3-c)carbazole-11,16-dione 9,9-dioxideIndanthren Yellow 6GDVat Yellow ZKh30,30-dioxo-30lambda6-thia-1,14,21-triazaoctacyclo[25.2.1.02,11.04,9.012,29.013,22.015,20.023,28]triaconta-2(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tridecaene-3,10-dioneIndanthren Printing Yellow 6G
Show more names
C.I.56080C.I.Vat Yellow 27Vat yellow 27 (C.I. 56080)
Indanthren Yellow 6GKC.I. Vat Yellow 27Caledon Printing Yellow 6GPalanthrene Printing Yellow 6GEINECS 228-376-3BRN 1095447C.I. 56080VAVINMPVFFDRLD-UHFFFAOYSA-N

Database identifiers

CAS
6252-73-9
PubChem CID
80400
DTXSID
DTXSID90211562
EC Number
228-376-3

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
107 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
0
Heavy atoms
34
Formal charge
0
Complexity
1,040

Chemistry & industry

Preparation methods

Preparation5-amino-benzo[α]thiophene-4-sulfonyl amine and 2,3-Dichloronaphthalene-1,4-dionecondensation.

Upstream & downstream products

Upstream raw materials

2,3-Dichloro-1,4-naphthoquinone

Suppliers1 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]

Related reactions

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Compound notes

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