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Details

Stereochemistry ACHIRAL
Molecular Formula C52H46O13
Molecular Weight 878.9138
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIPENTAERYTHRITYL HEXABENZOATE

SMILES

O=C(OCC(COCC(COC(=O)C1=CC=CC=C1)(COC(=O)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3)(COC(=O)C4=CC=CC=C4)COC(=O)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChIKey=NPORFUCNFHQOJH-UHFFFAOYSA-N
InChI=1S/C52H46O13/c53-45(39-19-7-1-8-20-39)60-33-51(34-61-46(54)40-21-9-2-10-22-40,35-62-47(55)41-23-11-3-12-24-41)31-59-32-52(36-63-48(56)42-25-13-4-14-26-42,37-64-49(57)43-27-15-5-16-28-43)38-65-50(58)44-29-17-6-18-30-44/h1-30H,31-38H2

HIDE SMILES / InChI

Molecular Formula C52H46O13
Molecular Weight 878.9138
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:49:24 GMT 2023
Edited
by admin
on Sat Dec 16 01:49:24 GMT 2023
Record UNII
S60GC37549
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIPENTAERYTHRITYL HEXABENZOATE
Common Name English
DIPENTAERYTHRITOL HEXABENZOATE
Common Name English
1,3-PROPANEDIOL, 2,2'-(OXYBIS(METHYLENE))BIS(2-((BENZOYLOXY)METHYL)-, TETRABENZOATE
Common Name English
Code System Code Type Description
CAS
122931-53-7
Created by admin on Sat Dec 16 01:49:24 GMT 2023 , Edited by admin on Sat Dec 16 01:49:24 GMT 2023
PRIMARY
FDA UNII
S60GC37549
Created by admin on Sat Dec 16 01:49:24 GMT 2023 , Edited by admin on Sat Dec 16 01:49:24 GMT 2023
PRIMARY
PUBCHEM
67878429
Created by admin on Sat Dec 16 01:49:24 GMT 2023 , Edited by admin on Sat Dec 16 01:49:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID90153791
Created by admin on Sat Dec 16 01:49:24 GMT 2023 , Edited by admin on Sat Dec 16 01:49:24 GMT 2023
PRIMARY