U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C23H38N6O5
Molecular Weight 478.585
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of N,N',2-TRIS(6-ISOCYANATOHEXYL)-IMIDODICARBONIC DIAMIDE

SMILES

O=C=NCCCCCCNC(=O)N(CCCCCCN=C=O)C(=O)NCCCCCCN=C=O

InChI

InChIKey=QKOWXXDOHMJOMQ-UHFFFAOYSA-N
InChI=1S/C23H38N6O5/c30-19-24-13-7-1-3-10-16-27-22(33)29(18-12-6-5-9-15-26-21-32)23(34)28-17-11-4-2-8-14-25-20-31/h1-18H2,(H,27,33)(H,28,34)

HIDE SMILES / InChI

Molecular Formula C23H38N6O5
Molecular Weight 478.585
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 3
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Respiratory hypersensitivity in guinea pigs sensitized to 1,6-hexamethylene diisocyanate (HDI): comparison of results obtained with the monomer and homopolymers of HDI.
2002 Feb 28
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:41:22 GMT 2023
Edited
by admin
on Sat Dec 16 09:41:22 GMT 2023
Record UNII
F26Y090STF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N',2-TRIS(6-ISOCYANATOHEXYL)-IMIDODICARBONIC DIAMIDE
Common Name English
1,3-BIS(6-ISOCYANATOHEXYL)-1-(6-ISOCYANATOHEXYLCARBAMOYL)UREA
Systematic Name English
HDI-BIURET
Common Name English
ISOCYANIC ACID, TRIESTER WITH 1,3,5-TRIS(6-HYDROXYHEXYL)BIURET
Common Name English
N,N,N'-TRIS(6-ISOCYANATOHEXYL)DICARBONIMIDIC DIAMIDE
Systematic Name English
(6-ISOCYANATOHEXYL)IMINOBIS(CARBONYLIMINO)BIS(HEXAMETHYLENE)DIISOCYANATE
Systematic Name English
N-BIS(6-ISOCYANATOHEXAMETHYLENECARBAMOYL)-6-AMINOHEXAMETHYLENE ISOCYANATE
Systematic Name English
BIURET, 1,3,5-TRIS(6-HYDROXYHEXYL)-, TRIISOCYANATE (ESTER)
Common Name English
1-((6-ISOCYANATOHEXYL)CARBAMOYL)-1,3-BIS(6-ISOCYANATOHEXYL)UREA
Systematic Name English
((2,4-DIOXO-1,3,5-TRIAZAPENTANE-1,3,5-TRIYL)TRISHEXAMETHYLENE)TRISISOCYANATE
Systematic Name English
J217.851F
Code English
HEXAMETHYLENE DIISOCYANATE BIURET
Systematic Name English
TRIS(6-ISOCYANATOHEXYL)BIURET
Systematic Name English
IMIDODICARBONIC DIAMIDE, N,N',2-TRIS(6-ISOCYANATOHEXYL)-
Common Name English
(6-(BIS((6-ISOCYANATOHEXYL)AMINOCARBONYL)AMINO)HEXYL) ISOCYANATE
Systematic Name English
HMDI BIURET
Common Name English
1,3,5-TRIS(6-HYDROXYHEXYL)BIURET TRIISOCYANATE
Systematic Name English
1,3,5-TRIS(6-ISOCYANATOHEXYL)BIURET
Systematic Name English
DESMODUR N-100
Brand Name English
N,N',N''-TRIS(6-ISOCYANATOHEXYL)BIURET
Systematic Name English
Code System Code Type Description
FDA UNII
F26Y090STF
Created by admin on Sat Dec 16 09:41:22 GMT 2023 , Edited by admin on Sat Dec 16 09:41:22 GMT 2023
PRIMARY
CAS
4035-89-6
Created by admin on Sat Dec 16 09:41:22 GMT 2023 , Edited by admin on Sat Dec 16 09:41:22 GMT 2023
PRIMARY
CHEBI
59101
Created by admin on Sat Dec 16 09:41:22 GMT 2023 , Edited by admin on Sat Dec 16 09:41:22 GMT 2023
PRIMARY
PUBCHEM
19950
Created by admin on Sat Dec 16 09:41:22 GMT 2023 , Edited by admin on Sat Dec 16 09:41:22 GMT 2023
PRIMARY
ECHA (EC/EINECS)
223-718-8
Created by admin on Sat Dec 16 09:41:22 GMT 2023 , Edited by admin on Sat Dec 16 09:41:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID6027555
Created by admin on Sat Dec 16 09:41:22 GMT 2023 , Edited by admin on Sat Dec 16 09:41:22 GMT 2023
PRIMARY