915924-65-1 Purity
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Specification
The molecular formula of Chembrdg-bb 4013668 is C10H12O3.
The PubChem CID of Chembrdg-bb 4013668 is 45791085.
The IUPAC name of Chembrdg-bb 4013668 is 5-(oxan-2-yl)furan-2-carbaldehyde.
The InChI of Chembrdg-bb 4013668 is InChI=1S/C10H12O3/c11-7-8-4-5-10(13-8)9-3-1-2-6-12-9/h4-5,7,9H,1-3,6H2.
The InChIKey of Chembrdg-bb 4013668 is JNMHKOWKQBQTIA-UHFFFAOYSA-N.
The canonical SMILES of Chembrdg-bb 4013668 is C1CCOC(C1)C2=CC=C(O2)C=O.
The molecular weight of Chembrdg-bb 4013668 is 180.20 g/mol.
The XLogP3-AA value of Chembrdg-bb 4013668 is 1.3.
Chembrdg-bb 4013668 has 0 hydrogen bond donor counts.
Chembrdg-bb 4013668 has 3 hydrogen bond acceptor counts.