2,3,5,6-Tetramethylbenzoic acid
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2,3,5,6-Tetramethylbenzoic acid
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CAS No:
2604-45-7
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Formula:
C11H14O2
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Chemical Name:
2,3,5,6-Tetramethylbenzoic acid
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Synonyms:
Benzoic acid,2,3,5,6-tetramethyl-;2,3,5,6-Tetramethylbenzoic acid;NSC 409541
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CAS No:
2,3,5,6-Tetramethylbenzoic acid Basic Attributes
178.22800
178.23
220-015-8
409541
DTXSID30180687
2916399090
Safety Information
NONH for all modes of transport
3
DH6835100
|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:178.23
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:178.099379685
Monoisotopic Mass:178.099379685
Topological Polar Surface Area:37.3
Heavy Atom Count:13
Complexity:186
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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