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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16O4
Molecular Weight 224.253
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MONO-O-BENZYLIDINEPENTAERYTHRITOL

SMILES

OCC1(CO)COC(OC1)C2=CC=CC=C2

InChI

InChIKey=DHWCGYXHBIWIPM-UHFFFAOYSA-N
InChI=1S/C12H16O4/c13-6-12(7-14)8-15-11(16-9-12)10-4-2-1-3-5-10/h1-5,11,13-14H,6-9H2

HIDE SMILES / InChI

Molecular Formula C12H16O4
Molecular Weight 224.253
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:42:26 GMT 2023
Edited
by admin
on Sat Dec 16 12:42:26 GMT 2023
Record UNII
45KS02OV17
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MONO-O-BENZYLIDINEPENTAERYTHRITOL
Systematic Name English
2-PHENYL-1,3-DIOXANE-5,5-DIMETHANOL
Systematic Name English
NSC-48280
Code English
M-DIOXANE-5,5-DIMETHANOL, 2-PHENYL-
Systematic Name English
(5-HYDROXYMETHYL-2-PHENYL-(1,3)DIOXAN-5-YL)METHANOL
Systematic Name English
5,5-BIS(HYDROXYMETHYL)-2-PHENYL-1,3-DIOXANE
Systematic Name English
1,3-DIOXANE-5,5-DIMETHANOL, 2-PHENYL-
Systematic Name English
Code System Code Type Description
CAS
2425-41-4
Created by admin on Sat Dec 16 12:42:26 GMT 2023 , Edited by admin on Sat Dec 16 12:42:26 GMT 2023
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FDA UNII
45KS02OV17
Created by admin on Sat Dec 16 12:42:26 GMT 2023 , Edited by admin on Sat Dec 16 12:42:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID70178947
Created by admin on Sat Dec 16 12:42:26 GMT 2023 , Edited by admin on Sat Dec 16 12:42:26 GMT 2023
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NSC
48280
Created by admin on Sat Dec 16 12:42:26 GMT 2023 , Edited by admin on Sat Dec 16 12:42:26 GMT 2023
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PUBCHEM
17042
Created by admin on Sat Dec 16 12:42:26 GMT 2023 , Edited by admin on Sat Dec 16 12:42:26 GMT 2023
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