1,4-Cyclohexane diisocyanate

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H10N2O2
Molecular Weight	166.1772
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 1,4-Cyclohexane diisocyanate

Structure Search

SMILES

O=C=NC1CCC(CC1)N=C=O

InChI

InChIKey=CDMDQYCEEKCBGR-UHFFFAOYSA-N

InChI=1S/C8H10N2O2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h7-8H,1-4H2

HIDE SMILES / InChI

Molecular Formula	C8H10N2O2
Molecular Weight	166.1772
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 17:40:42 GMT 2025` Edited by `admin` on `Tue Apr 01 17:40:42 GMT 2025`
Record UNII	86P2MTQ76N
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1,4-Diisocyanatocyclohexane

Preferred Name

English

1,4-Cyclohexane diisocyanate

Common Name

English

Cyclohexane, 1,4-diisocyanato-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

219-869-4

Created by admin on Tue Apr 01 17:40:42 GMT 2025 , Edited by admin on Tue Apr 01 17:40:42 GMT 2025

PRIMARY

PUBCHEM

17367

Created by admin on Tue Apr 01 17:40:42 GMT 2025 , Edited by admin on Tue Apr 01 17:40:42 GMT 2025

PRIMARY

CAS

2556-36-7

Created by admin on Tue Apr 01 17:40:42 GMT 2025 , Edited by admin on Tue Apr 01 17:40:42 GMT 2025

PRIMARY

FDA UNII

86P2MTQ76N

Created by admin on Tue Apr 01 17:40:42 GMT 2025 , Edited by admin on Tue Apr 01 17:40:42 GMT 2025

PRIMARY

EPA CompTox

DTXSID8062521

Created by admin on Tue Apr 01 17:40:42 GMT 2025 , Edited by admin on Tue Apr 01 17:40:42 GMT 2025

PRIMARY