3-(4-ISOBUTYL-PHENYL)-PROPIONIC ACID
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3-(4-ISOBUTYL-PHENYL)-PROPIONIC ACID
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CAS No:
65322-85-2
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Formula:
C13H18O2
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Chemical Name:
3-(4-ISOBUTYL-PHENYL)-PROPIONIC ACID
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Synonyms:
3-(4-ISOBUTYL-PHENYL)-PROPIONIC ACID;3-(p-Isobutylphenyl)propionic Acid;4-(2-Methylpropyl)benzenepropanoic Acid;Benzenepropanoic acid, 4-(2-Methylpropyl)-;Ibuprofen IMpurity-B(EP);Ibuprofen IMpurity-F(EP/BP);Imp. F:3-(4-isobutylphenyl)propanoic acid;Ibuprofen EP Impurity F
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CAS No:
3-(4-ISOBUTYL-PHENYL)-PROPIONIC ACID Basic Attributes
206.285
206.13100
35B9MX4RIO
DTXSID30215665
2916399090
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
3-(4-ISOBUTYL-PHENYL)-PROPIONIC ACID Use and Manufacturing
3-(4-Isobutylphenyl)propanoic acid is an impurity of Ibuprofen (I140000). Ibuprofen impurity F as per EP.
Computed Properties
Molecular Weight:206.28
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:206.130679813
Monoisotopic Mass:206.130679813
Topological Polar Surface Area:37.3
Heavy Atom Count:15
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(4-ISOBUTYL-PHENYL)-PROPIONIC ACID
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