4-(Methylsulfonyl)benzenepropanoic acid
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4-(Methylsulfonyl)benzenepropanoic acid
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CAS No:
387350-46-1
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Formula:
C10H12O4S
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Chemical Name:
4-(Methylsulfonyl)benzenepropanoic acid
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Synonyms:
Benzenepropanoic acid,4-(methylsulfonyl)-;4-(Methylsulfonyl)benzenepropanoic acid;3-[4-(Methylsulfonyl)phenyl]propanoic acid;4-Methylsulfonylbenzenepropanoic acid
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CAS No:
Safety Information
Xi
|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|Aggregated GHS information provided by 95 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:228.27
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:228.04563003
Monoisotopic Mass:228.04563003
Topological Polar Surface Area:79.8
Heavy Atom Count:15
Complexity:307
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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