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

Details

Stereochemistry MIXED
Molecular Formula C44H86N2O4
Molecular Weight 707.1646
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIHEXYLDECYL ISOPHORONE DIISOCYANATE

SMILES

CCCCCCCCC(CCCCCC)COC(=O)NCC1(C)CC(CC(C)(C)C1)NC(=O)OCC(CCCCCC)CCCCCCCC

InChI

InChIKey=XXRXLPISWRNWDZ-UHFFFAOYSA-N
InChI=1S/C44H86N2O4/c1-8-12-16-20-22-26-30-38(28-24-18-14-10-3)34-49-41(47)45-37-44(7)33-40(32-43(5,6)36-44)46-42(48)50-35-39(29-25-19-15-11-4)31-27-23-21-17-13-9-2/h38-40H,8-37H2,1-7H3,(H,45,47)(H,46,48)

HIDE SMILES / InChI

Molecular Formula C44H86N2O4
Molecular Weight 707.1646
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:59:31 GMT 2023
Edited
by admin
on Sat Dec 16 19:59:31 GMT 2023
Record UNII
53WI7BSF9K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIHEXYLDECYL ISOPHORONE DIISOCYANATE
Common Name English
DIHEXYLDECYL IPDI
INCI  
INCI  
Official Name English
DIHEXYLDECYL IPDI [INCI]
Common Name English
ISOCETYL IPDI
Common Name English
CARBAMIC ACID, (3-((((ISOHEXADECYLOXY)CARBONYL)AMINO)METHYL)-3,5,5-TRIMETHYLCYCLOHEXYL)-, ISOHEXADECYL ESTER
Common Name English
DIHEXADECYL IPDI
Common Name English
MONODERM I-16
Brand Name English
CARBAMIC ACID, N-(3-((((ISOHEXADECYLOXY)CARBONYL)AMINO)METHYL)-3,5,5-TRIMETHYLCYCLOHEXYL)-, ISOHEXADECYL ESTER
Common Name English
(±)-DIHEXADECYL IPDI
Common Name English
DIHEXADECYL IPDI, (±)-
Common Name English
Code System Code Type Description
CAS
185529-24-2
Created by admin on Sat Dec 16 19:59:31 GMT 2023 , Edited by admin on Sat Dec 16 19:59:31 GMT 2023
PRIMARY
FDA UNII
53WI7BSF9K
Created by admin on Sat Dec 16 19:59:31 GMT 2023 , Edited by admin on Sat Dec 16 19:59:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID10939978
Created by admin on Sat Dec 16 19:59:31 GMT 2023 , Edited by admin on Sat Dec 16 19:59:31 GMT 2023
PRIMARY
PUBCHEM
71587600
Created by admin on Sat Dec 16 19:59:31 GMT 2023 , Edited by admin on Sat Dec 16 19:59:31 GMT 2023
PRIMARY