IR-792 PERCHLORATE

• CAS: 207399-10-8
• Catalog Number: ACM207399108
• Category: Main Products
• Molecular Weight: 713.4g/mol
• Molecular Formula: C42H49ClN2O4S
• IUPAC Name: 2-[2-[3-[2-(3,3-dimethyl-1-propylindol-1-ium-2-yl)ethenyl]-2-phenylsulfanylcyclohex-2-en-1-ylidene]ethylidene]-3,3-dimethyl-1-propylindole;perchlorate
• Canonical SMILES: CCCN1C2=CC=CC=C2C(C1=CC=C3CCCC(=C3SC4=CC=CC=C4)C=CC5=[N+](C6=CC=CC=C6C5(C)C)CCC)(C)C.[O-]Cl(=O)(=O)=O
• InChI: InChI=1S/C42H49N2S.ClHO4/c1-7-29-43-36-23-14-12-21-34(36)41(3,4)38(43)27-25-31-17-16-18-32(40(31)45-33-19-10-9-11-20-33)26-28-39-42(5,6)35-22-13-15-24-37(35)44(39)30-8-2;2-1(3,4)5/h9-15,19-28H,7-8,16-18,29-30H2,1-6H3;(H,2,3,4,5)/q+1;/p-1
• InChI Key: IJYUKSSLCNLVNM-UHFFFAOYSA-M
• Appearance: Gold to Green powder
• Complexity: 1220
• Covalently-Bonded Unit Count: 2
• Exact Mass: 712.310157g/mol
• Formal Charge: 0
• H-Bond Acceptor: 6
• H-Bond Donor: 0
• Heavy Atom Count: 50
• Monoisotopic Mass: 712.310157g/mol
• Rotatable Bond Count: 9

Custom Q&A

What is the molecular formula of IR-792 perchlorate?

The molecular formula of IR-792 perchlorate is C42H49ClN2O4S.

What are the synonyms for IR-792 perchlorate?

The synonyms for IR-792 perchlorate are "IR-792 perchlorate (2Z)-2-[(2Z)-2-[3-[(E)-2-(3,3-dimethyl-1-propylindol-1-ium-2-yl)ethenyl]-2-phenylsulfanylcyclohex-2-en-1-ylidene]ethylidene]-3,3-dimethyl-1-propylindole;perchlorate".

What is the molecular weight of IR-792 perchlorate?

The molecular weight of IR-792 perchlorate is 713.4 g/mol.

What is the parent compound of IR-792 perchlorate?

The parent compound of IR-792 perchlorate has PubChem ID 87839255.

What are the component compounds of IR-792 perchlorate?

The component compounds of IR-792 perchlorate are PubChem ID 87839255 and PubChem ID 24247 (Perchloric Acid).

When was IR-792 perchlorate created?

IR-792 perchlorate was created on February 16, 2015.

When was IR-792 perchlorate last modified?

IR-792 perchlorate was last modified on December 2, 2023.

How many hydrogen bond donor counts does IR-792 perchlorate have?

IR-792 perchlorate has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does IR-792 perchlorate have?

IR-792 perchlorate has 6 hydrogen bond acceptor counts.

How many rotatable bond counts does IR-792 perchlorate have?

IR-792 perchlorate has 9 rotatable bond counts.