1,3-Propanediol, 2,2-dimethyl-, 1,3-dimethanesulfonate
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1,3-Propanediol, 2,2-dimethyl-, 1,3-dimethanesulfonate
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CAS No:
53555-41-2
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Formula:
C7H16O6S2
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Chemical Name:
1,3-Propanediol, 2,2-dimethyl-, 1,3-dimethanesulfonate
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Synonyms:
1,3-Propanediol,2,2-dimethyl-,1,3-dimethanesulfonate;1,3-Propanediol,2,2-dimethyl-,dimethanesulfonate;2,2-Dimethyl-1,3-propanediol dimethanesulfonate;NSC 171672;Neopentyl glycol dimethanesulfonate;2,2-Dimethylpropan-1,3-diyl dimethanesulfonate;2,2-Dimethylpropane-1,3-diyl dimethanesulfonate
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CAS No:
1,3-Propanediol, 2,2-dimethyl-, 1,3-dimethanesulfonate Basic Attributes
260.32800
260.33
171672
DTXSID20305786
2905199090
Safety Information
R41
S26; S36/39
Xi
|Danger|H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P280, P305+P351+P338, and P310|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:260.3
XLogP3:0.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:260.03883057
Monoisotopic Mass:260.03883057
Topological Polar Surface Area:104
Heavy Atom Count:15
Complexity:342
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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