Hexanedioic acid, 1-[2,2-bis(hydroxymethyl)butyl] ester
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![Hexanedioic acid, 1-[2,2-bis(hydroxymethyl)butyl] ester structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a923b90325af46b1ae2ac50f394504ac.png "Hexanedioic acid, 1-[2,2-bis(hydroxymethyl)butyl] ester")
Hexanedioic acid, 1-[2,2-bis(hydroxymethyl)butyl] ester
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CAS No:
20563-11-5
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Formula:
C12H22O6
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Chemical Name:
Hexanedioic acid, 1-[2,2-bis(hydroxymethyl)butyl] ester
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Synonyms:
Hexanedioic acid,1-[2,2-bis(hydroxymethyl)butyl] ester;Adipic acid,mono[2,2-bis(hydroxymethyl)butyl] ester;Hexanedioic acid,mono[2,2-bis(hydroxymethyl)butyl] ester;1,3-Propanediol,2-ethyl-2-(hydroxymethyl)-,mono(hydrogen adipate);Trimethylolpropane monoadipate;Emkarate 1080;[2,2-Bis(hydroxymethyl)butyl] hydrogen adipate
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CAS No:
Hexanedioic acid, 1-[2,2-bis(hydroxymethyl)butyl] ester Basic Attributes
262.29948
262.30
243-881-9
DTXSID70174565
Computed Properties
Molecular Weight:262.30
XLogP3:-0.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:11
Exact Mass:262.14163842
Monoisotopic Mass:262.14163842
Topological Polar Surface Area:104
Heavy Atom Count:18
Complexity:259
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Hexanedioic acid, 1-[2,2-bis(hydroxymethyl)butyl] ester
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