3,5-Dimethylbenzenepropanoic acid
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3,5-Dimethylbenzenepropanoic acid
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CAS No:
42287-87-6
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Formula:
C11H14O2
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Chemical Name:
3,5-Dimethylbenzenepropanoic acid
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Synonyms:
Benzenepropanoic acid,3,5-dimethyl-;3,5-Dimethylbenzenepropanoic acid;3-(3,5-Xylyl)propionic acid;3-(3,5-Dimethylphenyl)propionic acid
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CAS No:
Safety Information
NONH for all modes of transport
P305 + P351 + P338
H315-H319
|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:178.23
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:178.099379685
Monoisotopic Mass:178.099379685
Topological Polar Surface Area:37.3
Heavy Atom Count:13
Complexity:167
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3,5-Dimethylbenzenepropanoic acid
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