2,3,4,5,6-Pentamethylbenzoic acid
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2,3,4,5,6-Pentamethylbenzoic acid
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CAS No:
2243-32-5
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Formula:
C12H16O2
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Chemical Name:
2,3,4,5,6-Pentamethylbenzoic acid
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Synonyms:
Benzoic acid,2,3,4,5,6-pentamethyl-;Benzoic acid,pentamethyl-;2,3,4,5,6-Pentamethylbenzoic acid;Permethylbenzoic acid;Pentamethylbenzoic acid;NSC 245093
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CAS No:
2,3,4,5,6-Pentamethylbenzoic acid Basic Attributes
192.25400
192.25
218-809-4
245093
DTXSID20176953
2916399090
Safety Information
S22-S24/25
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, 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:192.25
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:192.115029749
Monoisotopic Mass:192.115029749
Topological Polar Surface Area:37.3
Heavy Atom Count:14
Complexity:208
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2,3,4,5,6-Pentamethylbenzoic acid
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