1,3-Bis(1,1-dimethylethyl) propanedioate
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1,3-Bis(1,1-dimethylethyl) propanedioate
structure -
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CAS No:
541-16-2
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Formula:
C11H20O4
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Chemical Name:
1,3-Bis(1,1-dimethylethyl) propanedioate
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Synonyms:
Propanedioic acid,1,3-bis(1,1-dimethylethyl) ester;Malonic acid,di-tert-butyl ester;Propanedioic acid,bis(1,1-dimethylethyl) ester;1,3-Bis(1,1-dimethylethyl) propanedioate;Di-tert-butyl malonate;tert-Butyl malonate;Bis(1,1-dimethylethyl) malonate;di-tert-butyl propanedioate;1,3-Di-tert-butyl propanedioate
- Categories:
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CAS No:
1,3-Bis(1,1-dimethylethyl) propanedioate Basic Attributes
216.27
216.27
1781766
208-769-6
7E9XWT9380
DTXSID8060244
29171910
Characteristics
52.6
2.1
Clear colorless to slightly yellow Liquid
1.0±0.1 g/cm3
-6 °C
101.5-102 °C @ Press: 15 Torr
88 °C
1.433
It is hardly soluble in water.
2-8°C
Safety Information
3
36/37/38-24/25
23-24/25
P261, P272, P280, P302+P352, P321, P333+P313, P363, P501
H317
|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501|Aggregated GHS information provided by 6 companies from 1 notifications to the ECHA C&L Inventory.
1,3-Bis(1,1-dimethylethyl) propanedioate Use and Manufacturing
In the preparation of ketones.
Propanedioic acid, 1,3-bis(1,1-dimethylethyl) ester: INACTIVE
Computed Properties
Molecular Weight:216.27
XLogP3:2.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:216.13615911
Monoisotopic Mass:216.13615911
Topological Polar Surface Area:52.6
Heavy Atom Count:15
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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