[2-(2,2-dimethylpropyl)phenyl]methylphosphonic acid

Systemtic Name: [2-(2,2-dimethylpropyl)phenyl]methylphosphonic acid Openeye Name: [2-(2,2-dimethylpropyl)phenyl]methylphosphonic acid CAS Name: [2-(2,2-dimethylpropyl)phenyl]methylphosphonic acid IUPAC Name: [2-(2,2-dimethylpropyl)phenyl]methylphosphonic acid Traditional Name: (2-neopentylbenzyl)phosphonic acid Formula: C12H19O3P MolecularWeight: 242.251221

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CC=CC=C1CP(=O)(O)O

Isomeric SMILES

CC(C)(C)CC1=CC=CC=C1CP(=O)(O)O

InChI

InChI=1S/C12H19O3P/c1-12(2,3)8-10-6-4-5-7-11(10)9-16(13,14)15/h4-7H,8-9H2,1-3H3,(H2,13,14,15)