2,4,5-Trimethylbenzoic acid
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2,4,5-Trimethylbenzoic acid
structure -
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CAS No:
528-90-5
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Formula:
C10H12O2
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Chemical Name:
2,4,5-Trimethylbenzoic acid
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Synonyms:
Benzoic acid,2,4,5-trimethyl-;2,4,5-Trimethylbenzoic acid;Durylic acid;NSC 147400
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CAS No:
Safety Information
IRRITANT
NONH for all modes of transport
3
24/25
DI0887000
Xi
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:164.20
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:164.083729621
Monoisotopic Mass:164.083729621
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:177
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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