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Details

Stereochemistry ACHIRAL
Molecular Formula C30H20N4O4
Molecular Weight 500.5042
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BIS(4-((4-ISOCYANATOPHENYL)METHYL)PHENYL)-1,3-DIAZETIDINE-2,4-DIONE

SMILES

O=C=NC1=CC=C(CC2=CC=C(C=C2)N3C(=O)N(C3=O)C4=CC=C(CC5=CC=C(C=C5)N=C=O)C=C4)C=C1

InChI

InChIKey=ARRNPOPZVLSDGB-UHFFFAOYSA-N
InChI=1S/C30H20N4O4/c35-19-31-25-9-1-21(2-10-25)17-23-5-13-27(14-6-23)33-29(37)34(30(33)38)28-15-7-24(8-16-28)18-22-3-11-26(12-4-22)32-20-36/h1-16H,17-18H2

HIDE SMILES / InChI

Molecular Formula C30H20N4O4
Molecular Weight 500.5042
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 17:58:21 GMT 2025
Edited
by admin
on Tue Apr 01 17:58:21 GMT 2025
Record UNII
64LS3M957X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BIS(4-((4-ISOCYANATOPHENYL)METHYL)PHENYL)-1,3-DIAZETIDINE-2,4-DIONE
Systematic Name English
1,3-DIAZETIDINE-2,4-DIONE, 1,3-BIS(4-((4-ISOCYANATOPHENYL)METHYL)PHENYL)-
Preferred Name English
2,4-DIOXO-1,3-DIAZETIDINE-1,3-DIYLBIS(P-PHENYLENEMETHYLENE-P-PHENYLENE) DIISOCYANATE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
241-559-2
Created by admin on Tue Apr 01 17:58:21 GMT 2025 , Edited by admin on Tue Apr 01 17:58:21 GMT 2025
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PUBCHEM
87165
Created by admin on Tue Apr 01 17:58:21 GMT 2025 , Edited by admin on Tue Apr 01 17:58:21 GMT 2025
PRIMARY
FDA UNII
64LS3M957X
Created by admin on Tue Apr 01 17:58:21 GMT 2025 , Edited by admin on Tue Apr 01 17:58:21 GMT 2025
PRIMARY
CAS
17589-24-1
Created by admin on Tue Apr 01 17:58:21 GMT 2025 , Edited by admin on Tue Apr 01 17:58:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID8066216
Created by admin on Tue Apr 01 17:58:21 GMT 2025 , Edited by admin on Tue Apr 01 17:58:21 GMT 2025
PRIMARY