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| CAS No.: | 1324-17-0 |
|---|---|
| Name: | THRENE BRILLIANT VIOLET 3B |
| Molecular Structure: | |
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| Formula: | C34H15BrO2 |
| Molecular Weight: | 535.39 |
| Synonyms: | C.I. VatViolet 9 (8CI);Isoviolanthrone, bromo- (7CI);Ahcovat Brilliant Violet 3B;Benzadone Brilliant Violet 3B;C.I. 60005;C.I. Pigment Violet 33;CaledonBrilliant Violet 3B;Caledon Printing Violet 3B;Carbanthrene Brilliant Violet3B;Carbanthrene Brilliant Violet 4B;Cibanone Violet 6B;Cibanone Violet F 6B;Fenanthren Brilliant Violet 3B;Helanthrene Violet 3B;Indanthren BrilliantViolet 3B;Indanthren Printing Violet F 3B;Indanthrene Brilliant Violet 3B;Lumatex Brilliant Violet R;Mikethrene Brilliant Violet 3B;Monobromoisodibenzanthrone;Nihonthrene Brilliant Violet 3B;Palanthrene BrilliantViolet 3B;Palanthrene Printing Violet F 3B;Paradone Brilliant Violet 3B;Pernithrene Brilliant Violet 3B;Ponsol Brilliant Violet 3B;RomantreneBrilliant Violet F 3B;Sandothrene Violet N 3B;Solanthrene Brilliant Violet3B;Tinon Violet 6B;Tyrian Brilliant Violet I 3B; |
| EINECS: | 215-365-3 |
| Density: | 1.657 g/cm3 |
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Chemistry
Molecular Structure of Vat Violet 9 (CAS NO.1324-17-0):
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Systematic Name: 3-Bromobenzo[rst]phenanthro[10,1,2-cde]pentaphene-9,18-dione
Molecular Formula: C34H15BrO2
Molecular Weight: 535.39
EINECS: 215-365-3
XLogP3-AA: 8.7
H-Bond Donor: 0
H-Bond Acceptor: 2
Rotatable Bond Count: 0
Exact Mass: 534.025542
MonoIsotopic Mass: 534.025542
Topological Polar Surface Area: 34.1
Heavy Atom Count: 37
Complexity: 990
Index of Refraction: 1.926
Molar Refractivity: 153.34 cm3
Molar Volume: 323 cm3
Surface Tension: 83.3 dyne/cm
Density: 1.657 g/cm3
Canonical SMILES: C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=CC=C7C8=C(C=CC5=C68)C9=C(C7=O)C=CC(=C9)Br)C2=O
InChI: InChI=1S/C34H15BrO2/c35-16-5-6-25-28(15-16)23-10-9-20-21-11-13-26-31-18(17-3-1-2-4-24(17)33(26)36)7-8-19(29(21)31)22-12-14-27(34(25)37)32(23)30(20)22/h1-15H
InChIKey: JYNGSWOTISMOGI-UHFFFAOYSA-N
Specification
Vat Violet 9 (CAS NO.1324-17-0), its Synonyms are Benzo(rst)phenanthro(10,1,2-cde)pentaphene-9,18-dione, bromo- ; Bromobenzo(rst)phenanthro(10,1,2-cde)pentaphene-9,18-dione ; C.I. VatViolet 9 (8CI) ; Isoviolanthrone, bromo- (7CI) ; Ahcovat Brilliant Violet 3B ; Benzadone Brilliant Violet 3B ; CaledonBrilliant Violet 3B ; Caledon Printing Violet 3B ; Carbanthrene Brilliant Violet3B ; Carbanthrene Brilliant Violet 4B ; Cibanone Violet 6B ; Cibanone Violet F 6B ; Fenanthren Brilliant Violet 3B ; Helanthrene Violet 3B ; Indanthren BrilliantViolet 3B ; Indanthren Printing Violet F 3B ; Indanthrene Brilliant Violet 3B ; Lumatex Brilliant Violet R ; Mikethrene Brilliant Violet 3B ; Monobromoisodibenzanthrone ; Nihonthrene Brilliant Violet 3B ; Palanthrene BrilliantViolet 3B ; Palanthrene Printing Violet F 3B ; Paradone Brilliant Violet 3B .