5-Bromo-2-(methoxymethoxy)pyridine

• CAS: 247189-74-8
• Catalog Number: ACM247189748
• Category: Bromine Series
• Molecular Weight: 218.047920 [g/mol]
• Molecular Formula: C₇H₈BrNO₂
• Synonyms: 5-bromo-2-(methoxymethoxy)pyridine, 247189-74-8, AKOS016014203, RL02800, AK129579, KB-41895
• IUPAC Name: 5-bromo-2-(methoxymethoxy)pyridine
• SMILES: COCOC1=NC=C(C=C1)Br
• InChI Key: FIJXQBUMQGSMKD-UHFFFAOYSA-N
• Exact Mass: 216.97400
• H-Bond Acceptor: 3
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of the compound?

The molecular formula is C7H8BrNO2.

What is the molecular weight of the compound?

The molecular weight is 218.05 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 5-bromo-2-(methoxymethoxy)pyridine.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C7H8BrNO2/c1-10-5-11-7-3-2-6(8)4-9-7/h2-4H,5H2,1H3.

What is the InChIKey of the compound?

The InChIKey of the compound is FIJXQBUMQGSMKD-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is COCOC1=NC=C(C=C1)Br.

How many hydrogen bond donor counts does the compound have?

The compound has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does the compound have?

The compound has 3 hydrogen bond acceptor counts.

How many rotatable bond counts does the compound have?

The compound has 3 rotatable bond counts.

Is the compound considered canonicalized?

Yes, the compound is considered canonicalized.