2-propan-2-yloxane-4-carboxylic acid
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2-propan-2-yloxane-4-carboxylic acid
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CAS No:
77554-89-3
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Formula:
C9H16O3
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Chemical Name:
2-propan-2-yloxane-4-carboxylic acid
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Synonyms:
2-ISOPROPYLTETRAHYDRO-2H-PYRAN-4-CARBOXYLIC ACID; 2-Isopropyl-tetrahydropyran-4-carbonsaeure;
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CAS No:
2-propan-2-yloxane-4-carboxylic acid Basic Attributes
172.22200
172.109944368
DTXSID00505323
2932999099
Safety Information
|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, 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:172.22
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:172.109944368
Monoisotopic Mass:172.109944368
Topological Polar Surface Area:46.5
Heavy Atom Count:12
Complexity:165
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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