1-HYDROXY-CYCLOHEXANECARBOXYLICACID
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1-HYDROXY-CYCLOHEXANECARBOXYLICACID
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CAS No:
1123-28-0
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Formula:
C7H12O3
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Chemical Name:
1-HYDROXY-CYCLOHEXANECARBOXYLICACID
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Synonyms:
1-Hydroxycyclohexanecarboxylic acid;1-Hydroxy-cyclohexanecarboxylic acid;1-hydroxycyclohexane-1-carboxylic acid;Cyclohexanecarboxylic acid, 1-hydroxy-;SCHEMBL18682;CTK0I2820;DTXSID00277215;NSC1182;ZINC390990;1-hydroxycyclohexane-carboxylic acid
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CAS No:
1-HYDROXY-CYCLOHEXANECARBOXYLICACID Basic Attributes
144.17
144.078644
143384|1182
DTXSID00277215
2918199090
Safety Information
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1-HYDROXY-CYCLOHEXANECARBOXYLICACID Use and Manufacturing
A solution of sodium metabisulfate (4.84 g, 0.025 mol) in distilled water (20 mL) was added over 30 min to a stirred mixture of cyclohexanone 1 (4.02 g, 0.041 mol), potassium cyanide (3.3 g, 0.051 mol), and water (20 mL). The mixture was stirred at 25° C. for 8 hrs. The mixture was extracted with ethyl acetate (2×100 mL) and the organics dried (MgSO
Computed Properties
Molecular Weight:144.17
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:144.078644241
Monoisotopic Mass:144.078644241
Topological Polar Surface Area:57.5
Heavy Atom Count:10
Complexity:136
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
1-HYDROXY-CYCLOHEXANECARBOXYLICACID
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