(2E)-3-[4-(METHYLSULFONYL)PHENYL]PROPENOICACID
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![(2E)-3-[4-(METHYLSULFONYL)PHENYL]PROPENOICACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7768b4cb8d3d4ae7a0ed60308211d1bd.png "(2E)-3-[4-(METHYLSULFONYL)PHENYL]PROPENOICACID")
(2E)-3-[4-(METHYLSULFONYL)PHENYL]PROPENOICACID
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CAS No:
5345-30-2
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Formula:
C10H10O4S
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Chemical Name:
(2E)-3-[4-(METHYLSULFONYL)PHENYL]PROPENOICACID
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Synonyms:
RARECHEM BK HW 0232;3-(4-mesylphenyl)acrylic acid;4-(Methlsulphonyl)cinnamic acid;4-(Methylsulphonyl)cinnamic acid;3-(4-methylsulfonylphenyl)prop-2-enoic acid;(2E)-3-[4-(METHYLSULFONYL)PHENYL]PROPENOIC ACID;3-[4-(METHYLSULFONYL)PHENYL]-(2E)-PROPENOIC ACID;3-[4-(METHYLSULPHONYL)PHENYL]-(2E)-PROPENOIC ACID
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CAS No:
Safety Information
Xi
Irritant
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|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:226.25
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:226.02997997
Monoisotopic Mass:226.02997997
Topological Polar Surface Area:79.8
Heavy Atom Count:15
Complexity:342
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
(2E)-3-[4-(METHYLSULFONYL)PHENYL]PROPENOICACID
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