3-Carboxy-α-methylbenzeneacetic acid
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3-Carboxy-α-methylbenzeneacetic acid
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CAS No:
68432-95-1
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Formula:
C10H10O4
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Chemical Name:
3-Carboxy-α-methylbenzeneacetic acid
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Synonyms:
Benzeneacetic acid,3-carboxy-α-methyl-;3-Carboxy-α-methylbenzeneacetic acid;DF 2008Y;3-(1-Carboxyethyl)benzoic acid
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CAS No:
Safety Information
NONH for all modes of transport
P201, P202, P260, P261, P263, P264, P270, P271, P272, P273, P280, P281, P301+P310, P302+P352, P304+P340, P308+P313, P311, P312, P321, P322, P330, P333+P313, P361, P363, P403+P233, P405, P501
H301
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P201, P202, P260, P261, P263, P264, P270, P271, P272, P273, P280, P281, P301+P310, P302+P352, P304+P340, P308+P313, P311, P312, P321, P322, P330, P333+P313, P361, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:194.18
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:194.05790880
Monoisotopic Mass:194.05790880
Topological Polar Surface Area:74.6
Heavy Atom Count:14
Complexity:236
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-Carboxy-α-methylbenzeneacetic acid
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