96631-87-7 Purity
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Specification
The molecular formula of 5-Bromoindoline is C8H8BrN.
The molecular weight of 5-Bromoindoline is 198.06 g/mol.
The PubChem CID for 5-Bromoindoline was created on September 8, 2005, and last modified on December 30, 2023.
The IUPAC name of 5-Bromoindoline is 5-bromo-2,3-dihydro-1H-indole.
The Canonical SMILES representation of 5-Bromoindoline is C1CNC2=C1C=C(C=C2)Br.
The InChIKey of 5-Bromoindoline is QEDCHCLHHGGYBT-UHFFFAOYSA-N.
The CAS number of 5-Bromoindoline is 22190-33-6.
The XLogP3 value of 5-Bromoindoline is 2.9.
5-Bromoindoline has 1 hydrogen bond donor count and 1 hydrogen bond acceptor count.
Yes, 5-Bromoindoline is a canonicalized compound according to PubChem.