Ianbd ester

• CAS: 67013-48-3
• Catalog Number: ACM67013483
• Category: Other Products
• Molecular Weight: 406.13
• Molecular Formula: C₁₁H₁₁IN₄O₅
• Synonyms: 4-(n-(iodoacetoxy)ethyl-n-methyl)amino-7-nitrobenz-2-oxa-1,3-diazole;IANBD ESTER;N-((2-(IODOACETOXY)ETHYL)-N-METHYL)AMINO-7-NITROBENZ-2-OXA-1,3-DIAZOLE;N-((2-(Iodoacetoxy)ethyl)-N- methyl)amino-7-nitrobenz-2-oxa-1,3-diazole

Custom Q&A

What is the molecular formula of IANBD ester?

The molecular formula of IANBD ester is C11H11IN4O5.

When was IANBD ester created and last modified?

IANBD ester was created on 2005-07-19 and last modified on 2023-12-30.

What is the IUPAC name of IANBD ester?

The IUPAC name of IANBD ester is 2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethyl 2-iodoacetate.

What is the InChI of IANBD ester?

The InChI of IANBD ester is InChI=1S/C11H11IN4O5/c1-15(4-5-20-9(17)6-12)7-2-3-8(16(18)19)11-10(7)13-21-14-11/h2-3H,4-6H2,1H3.

What is the Canonical SMILES of IANBD ester?

The Canonical SMILES of IANBD ester is CN(CCOC(=O)CI)C1=CC=C(C2=NON=C12)[N+](=O)[O-].

What is the molecular weight of IANBD ester?

The molecular weight of IANBD ester is 406.13 g/mol.

How many hydrogen bond donor counts does IANBD ester have?

IANBD ester has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does IANBD ester have?

IANBD ester has 8 hydrogen bond acceptor counts.

How many rotatable bond counts does IANBD ester have?

IANBD ester has 6 rotatable bond counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.