Vat Violet 10

• CAS: 128-64-3
• Catalog Number: ACM128643
• Category: Vat Dyes
• Molecular Weight: 456.5g/mol
• Molecular Formula: C34H16O2
• IUPAC Name: nonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.021,26.028,32]tetratriaconta-1(30),2,4,6,8,10,13,15,17(31),18,20(32),21,23,25,28,33-hexadecaene-12,27-dione
• Canonical SMILES: C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=CC=C7C8=C(C=CC5=C68)C9=CC=CC=C9C7=O)C2=O
• InChI: InChI=1S/C34H16O2/c35-33-25-7-3-1-5-17(25)19-9-11-21-24-14-16-28-32-20(18-6-2-4-8-26(18)34(28)36)10-12-22(30(24)32)23-13-15-27(33)31(19)29(21)23/h1-16H
• InChI Key: BSIHWSXXPBAGTC-UHFFFAOYSA-N
• Complexity: 877
• Covalently-Bonded Unit Count: 1
• EC Number: 204-901-1
• Exact Mass: 456.11503g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 36
• Monoisotopic Mass: 456.11503g/mol
• NSC Number: 5268
• Rotatable Bond Count: 0
• XLogP3: 8

Custom Q&A

What is the PubChem CID of Vat Violet 10?

The PubChem CID of Vat Violet 10 is 67189.

What is the molecular formula of Vat Violet 10?

The molecular formula of Vat Violet 10 is C34H16O2.

What is the molecular weight of Vat Violet 10?

The molecular weight of Vat Violet 10 is 456.5 g/mol.

What is the IUPAC name of Vat Violet 10?

The IUPAC name of Vat Violet 10 is nonacyclo[18.10.2.2 2,5 .0 3,16 .0 4,13 .0 6,11 .0 17,31 .0 21,26 .0 28,32 ]tetratriaconta-1(30),2,4,6,8,10,13,15,17(31),18,20(32),21,23,25,28,33-hexadecaene-12,27-dione.

What is the InChI of Vat Violet 10?

The InChI of Vat Violet 10 is InChI=1S/C34H16O2/c35-33-25-7-3-1-5-17(25)19-9-11-21-24-14-16-28-32-20(18-6-2-4-8-26(18)34(28)36)10-12-22(30(24)32)23-13-15-27(33)31(19)29(21)23/h1-16H.

What is the InChIKey of Vat Violet 10?

The InChIKey of Vat Violet 10 is BSIHWSXXPBAGTC-UHFFFAOYSA-N.

What is the canonical SMILES of Vat Violet 10?

The canonical SMILES of Vat Violet 10 is C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=CC=C7C8=C(C=CC5=C68)C9=CC=CC=C9C7=O)C2=O.

What is the CAS number of Vat Violet 10?

The CAS number of Vat Violet 10 is 128-64-3.

What is the EC number of Vat Violet 10?

The EC number of Vat Violet 10 is 204-901-1.

Synthetic Use

Upstream Synthesis Route 1

• 82-05-3

• 116-71-2
• 128-64-3

Reference: [1] Justus Liebigs Annalen der Chemie, 1929, vol. 473, p. 278

Upstream Synthesis Route 2

• 116-90-5

• 116-71-2
• 128-64-3

Reference: [1] Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 15, p. 746

Upstream Synthesis Route 3

• 82-05-3
• 6409-44-5

• 128-64-3

Reference: [1]Current Patent Assignee: I.G. FARBENINDUSTRIE AG (historic) - DE436888, 1926, C
[Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 15, p. 748][Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 15, p. 748]
[2]Current Patent Assignee: I.G. FARBENINDUSTRIE AG (historic) - DE436888, 1926, C
[Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 15, p. 748][Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 15, p. 748]
[3]Current Patent Assignee: I.G. FARBENINDUSTRIE AG (historic) - DE436888, 1926, C
[Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 15, p. 748][Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 15, p. 748]

Upstream Synthesis Route 4

• 82-05-3
• 81-96-9
• 141-52-6

• 128-64-3

Reference: [1]Patent: DE436888,

Upstream Synthesis Route 5

• 82-05-3
• 81-96-9

• 128-64-3

Reference: [1]Patent: DE436888,