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Chemical structure of Ibuprofen impurity 1

GC60926

Ibuprofen impurity 1

Also known as 2-(4-propylphenyl)propanoic acid

Ibuprofen impurity 1 is an Ibuprofen impurity

ChemicalCAS3585-47-5MW192.25FormulaC12H16O2
CAS number
3585-47-5
Molecular weight
192.25
Formula
C12H16O2
InChIKey
DMJYWNOMDAPUTN-UHFFFAOYSA-N
Catalogue number
GC60926
Brand
GLPBIO
Computed properties PubChem CID 14880971 · XLogP 3.2 · TPSA 37.3 Ų · H-bond donors 1
XLogP
3.2
TPSA
37.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
14

SMILES CCCC1=CC=C(C=C1)C(C)C(=O)O

Computed descriptors from PubChem (CID 14880971), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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