Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
Vanilla / Vanillin 148-53-8 8991

Structure Other Information
Canonical SMILES COC1=CC=CC(=C1O)C=O
Iso SMILES COC1=CC=CC(=C1O)C=O
InChI InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-5,10H,1H3
InChI Key JJVNINGBHGBWJH-UHFFFAOYSA-N
Formula C8H8O3
Mol Weight 152.147
XlogP3 1.4
Charge 0

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Synonyms Information
CAS Name 2-hydroxy-3-methoxybenzaldehyde
IUPAC Name 2-hydroxy-3-methoxy-benzaldehyde
Openeye Name 2-hydroxy-3-methoxybenzaldehyde
Systematic Name 3-methoxy-2-oxidanyl-benzaldehyde
Tratitional Name 3-methoxy-2-oxidanyl-benzaldehyde