3,3-Dimethyl-1,2,4-butanetriol
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3,3-Dimethyl-1,2,4-butanetriol
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CAS No:
15833-80-4
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Formula:
C6H14O3
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Chemical Name:
3,3-Dimethyl-1,2,4-butanetriol
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Synonyms:
1,2,4-Butanetriol,3,3-dimethyl-;3,3-Dimethyl-1,2,4-butanetriol
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CAS No:
Safety Information
|Warning|H315 (100%): 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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:134.17
XLogP3:-0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:134.094294304
Monoisotopic Mass:134.094294304
Topological Polar Surface Area:60.7
Heavy Atom Count:9
Complexity:80.4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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