2,4,5-Trimethylbenzenesulfonic acid
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2,4,5-Trimethylbenzenesulfonic acid
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CAS No:
3453-84-7
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Formula:
C9H12O3S
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Chemical Name:
2,4,5-Trimethylbenzenesulfonic acid
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Synonyms:
Benzenesulfonic acid,2,4,5-trimethyl-;2,4,5-Trimethylbenzenesulfonic acid;1,2,4-Trimethyl-5-benzenesulfonic acid;Pseudocumene-5-sulfonic acid;NSC 163978;2,4,5-Trimethylbenzene-1-sulfonic acid
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CAS No:
Safety Information
34
26-27-36/37/39-45
C
|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:200.26
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:200.05071541
Monoisotopic Mass:200.05071541
Topological Polar Surface Area:62.8
Heavy Atom Count:13
Complexity:265
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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