3-(2,2-dimethylpropanoylamino)-4-methylbenzoic acid
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3-(2,2-dimethylpropanoylamino)-4-methylbenzoic acid
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CAS No:
915923-72-7
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Formula:
C13H17NO3
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Chemical Name:
3-(2,2-dimethylpropanoylamino)-4-methylbenzoic acid
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CAS No:
3-(2,2-dimethylpropanoylamino)-4-methylbenzoic acid Basic Attributes
235.27900
235.12084340
DTXSID20588239
2924299090
Safety Information
|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:235.28
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:235.12084340
Monoisotopic Mass:235.12084340
Topological Polar Surface Area:66.4
Heavy Atom Count:17
Complexity:306
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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