3,5-Diisopropylsalicylic acid
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3,5-Diisopropylsalicylic acid
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CAS No:
2215-21-6
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Formula:
C13H18O3
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Chemical Name:
3,5-Diisopropylsalicylic acid
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Synonyms:
Benzoic acid,2-hydroxy-3,5-bis(1-methylethyl)-;Salicylic acid,3,5-diisopropyl-;2-Hydroxy-3,5-bis(1-methylethyl)benzoic acid;3,5-Diisopropylsalicylic acid;3,5-Diisopropyl-2-hydroxybenzoic acid;2-Hydroxy-3,5-diisopropylbenzoic acid;2-Hydroxy-3,5-bis(propan-2-yl)benzoic acid
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CAS No:
Characteristics
57.53000
3.33720
beige to grey crystalline powder
1.108g/cm3
118.5 °C
324.5ºC at 760mmHg
164.3ºC
0.0001mmHg at 25°C
Safety Information
NONH for all modes of transport
3
36/37
S22-S26-S37/39
Xi: Irritant;
P261-P305 + P351 + P338
H319-H335
|Warning|H315 (11.63%): 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 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
3,5-Diisopropylsalicylic acid Use and Manufacturing
Benzoic acid, 2-hydroxy-3,5-bis(1-methylethyl)-: ACTIVE
Computed Properties
Molecular Weight:222.28
XLogP3:5.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:222.125594432
Monoisotopic Mass:222.125594432
Topological Polar Surface Area:57.5
Heavy Atom Count:16
Complexity:248
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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