3-methoxycarbonyl-4-methylbenzoic acid
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3-methoxycarbonyl-4-methylbenzoic acid
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CAS No:
167300-06-3
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Formula:
C10H10O4
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Chemical Name:
3-methoxycarbonyl-4-methylbenzoic acid
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Synonyms:
3-(Methoxycarbonyl)-4-methylbenzoic acid; 4-Methyl-3-(methoxycarbonyl)benzoic acid; 4-methyl-3-[(methyloxy)carbonyl]benzoic acid; 4-methyl-isophthalic acid 3-methyl ester; Methyl-2-methyl-5-carboxylicbenzoic acid;
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CAS No:
3-methoxycarbonyl-4-methylbenzoic acid Basic Attributes
194.18400
194.05790880
DTXSID70622273
2918990090
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:194.18
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:194.05790880
Monoisotopic Mass:194.05790880
Topological Polar Surface Area:63.6
Heavy Atom Count:14
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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