[3-hydroxy-2,2-bis(hydroxymethyl)propyl] acetate
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[3-hydroxy-2,2-bis(hydroxymethyl)propyl] acetate
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CAS No:
13051-29-1
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Formula:
C7H14O5
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Chemical Name:
[3-hydroxy-2,2-bis(hydroxymethyl)propyl] acetate
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Synonyms:
13051-29-1;[3-hydroxy-2,2-bis(hydroxymethyl)propyl] acetate;NSC164617;pentaerythritol monoacetate;SCHEMBL725624;DTXSID40304216;ZINC398825;AKOS024337405;MCULE-3290614889;NSC-164617;3-hydroxy-2,2-bis(hydroxymethyl)propyl acetate;2-(Hydroxymethyl)-2-(acetoxymethyl)propane-1,3-diol
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CAS No:
[3-hydroxy-2,2-bis(hydroxymethyl)propyl] acetate Basic Attributes
178.18 g/mol
178.08412354 g/mol
164617
DTXSID40304216
Computed Properties
Molecular Weight:178.18
XLogP3:-1.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:178.08412354
Monoisotopic Mass:178.08412354
Topological Polar Surface Area:87
Heavy Atom Count:12
Complexity:133
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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