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2-phenylethanesulfonic acid

2-phenylethanesulfonic acid structure

2-phenylethanesulfonic acid 

structure
  • CAS No:

    34292-93-8

  • Formula:

    C8H10O3S

  • Chemical Name:

    2-phenylethanesulfonic acid

  • Synonyms:

    2-phenylethanesulfonic acid;2-phenylethane-1-sulfonic acid;2-Phenyl-athansulfonsaure;SCHEMBL248501;CHEMBL3800698;ZINC1604315;AKOS016371025;MCULE-8029828252;34292-93-8;DS-013561

2-phenylethanesulfonic acid Basic Attributes

186.23 g/mol

186.03506535 g/mol

Characteristics

62.8 Ų

Safety Information

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, 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:186.23
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:186.03506535
Monoisotopic Mass:186.03506535
Topological Polar Surface Area:62.8
Heavy Atom Count:12
Complexity:209
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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