HITCI

• CAS: 19764-96-6
• Catalog Number: ACM19764966-2
• Category: Other Fluorophores
• Molecular Weight: 536.49
• Molecular Formula: C29H33IN2
• Synonyms: Hexacyanine3,HITCiodide,HTCiodide,LC8500,1,1',3,3,3',3'-Hexamethylindotricarbocyanineiodide,2-[7-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3,5-heptatrienyl]-1,3,3-trimethyl-3H-indoliumiodide
• IUPAC Name: 1,3,3-trimethyl-2-[7-(1,3,3-trimethylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]indole;iodide
• Canonical SMILES: CC1(C2=CC=CC=C2[N+](=C1C=CC=CC=CC=C3C(C4=CC=CC=C4N3C)(C)C)C)C.[I-]
• InChI: InChI=1S/C29H33N2.HI/c1-28(2)22-16-12-14-18-24(22)30(5)26(28)20-10-8-7-9-11-21-27-29(3,4)23-17-13-15-19-25(23)31(27)6;/h7-21H,1-6H3;1H/q+1;/p-1
• InChI Key: JKXWXYURKUEZHV-UHFFFAOYSA-M
• Melting Point: 198 °C
• Appearance: Brown crystalline solid
• Storage: Stored at RT
• Complexity: 756
• Covalently-Bonded Unit Count: 2
• EC Number: 243-282-2
• Exact Mass: 536.16885g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 32
• Monoisotopic Mass: 536.16885g/mol
• Rotatable Bond Count: 4

Custom Q&A

What is the molecular formula of HIDC iodide?

The molecular formula of HIDC iodide is C27H31IN2.

What are some synonyms of HIDC iodide?

Some synonyms of HIDC iodide include DiIC1(5), Hexacyanine 2, and 2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)penta-1,3-dienyl]-1,3,3-trimethyl-3H-indolium iodide.

What is the molecular weight of HIDC iodide?

The molecular weight of HIDC iodide is 510.5 g/mol.

What is the IUPAC name of HIDC iodide?

The IUPAC name of HIDC iodide is 1,3,3-trimethyl-2-[5-(1,3,3-trimethylindol-1-ium-2-yl)penta-2,4-dienylidene]indole;iodide.

What is the InChIKey of HIDC iodide?

The InChIKey of HIDC iodide is UANMYOBKUNUUTR-UHFFFAOYSA-M.

What is the Canonical SMILES of HIDC iodide?

The Canonical SMILES of HIDC iodide is CC1(C2=CC=CC=C2[N+](=C1C=CC=CC=C3C(C4=CC=CC=C4N3C)(C)C)C)C.[I-]

What is the CAS number of HIDC iodide?

The CAS number of HIDC iodide is 36536-22-8.

How many hydrogen bond acceptor count does HIDC iodide have?

HIDC iodide has two hydrogen bond acceptor counts.

What is the exact mass of HIDC iodide?

The exact mass of HIDC iodide is 510.15320 g/mol.

How many rotatable bond count does HIDC iodide have?

HIDC iodide has three rotatable bond counts.

What is the molecular formula of HIDC iodide according to the reference?

The molecular formula of HIDC iodide is C27H31IN2.

What are some synonyms of HIDC iodide mentioned in the reference?

Some synonyms of HIDC iodide mentioned in the reference are DiIC1(5) and Hexacyanine 2.

What is the IUPAC name of HIDC iodide according to the reference?

The IUPAC name of HIDC iodide is 1,3,3-trimethyl-2-[5-(1,3,3-trimethylindol-1-ium-2-yl)penta-2,4-dienylidene]indole;iodide.

What is the InChIKey of HIDC iodide mentioned in the reference?

The InChIKey of HIDC iodide is UANMYOBKUNUUTR-UHFFFAOYSA-M.

What is the Canonical SMILES representation of HIDC iodide according to the reference?

The Canonical SMILES representation of HIDC iodide is CC1(C2=CC=CC=C2[N+](=C1C=CC=CC=C3C(C4=CC=CC=C4N3C)(C)C)C).[I-].

How many hydrogen bond acceptors does HIDC iodide have?

HIDC iodide has 2 hydrogen bond acceptors.

What is the topological polar surface area of HIDC iodide mentioned in the reference?

The topological polar surface area of HIDC iodide is 6.2 2.

How many rotatable bond counts does HIDC iodide have?

HIDC iodide has 3 rotatable bond counts.

What is the complexity value of HIDC iodide mentioned in the reference?

The complexity value of HIDC iodide is 689.