Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
4-tert-Butylbenzoic acid 98-73-7 7403
Structure Other Information
Canonical SMILES CC(C)(C)C1=CC=C(C=C1)C(=O)O
Iso SMILES CC(C)(C)C1=CC=C(C=C1)C(=O)O
InChI InChI=1S/C11H14O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13)
InChI Key KDVYCTOWXSLNNI-UHFFFAOYSA-N
Formula C11H14O2
Mol Weight 178.228
XlogP3 3.9
Charge 0

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Synonyms Information
CAS Name 4-tert-butylbenzoic acid
IUPAC Name 4-tert-butylbenzoic acid
Openeye Name 4-tert-butylbenzoic acid
Systematic Name 4-tert-butylbenzoic acid
Tratitional Name 4-tert-butylbenzoic acid