3-ISOPROPENYL-.ALPHA.,.ALPHA.-DIMETHYLBENZYL ISOCYANATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H15NO
Molecular Weight	201.2643
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 3-ISOPROPENYL-.ALPHA.,.ALPHA.-DIMETHYLBENZYL ISOCYANATE

Structure Search

SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)N=C=O

InChI

InChIKey=ZVEMLYIXBCTVOF-UHFFFAOYSA-N

InChI=1S/C13H15NO/c1-10(2)11-6-5-7-12(8-11)13(3,4)14-9-15/h5-8H,1H2,2-4H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

3-ISOPROPENYL-.ALPHA.,.ALPHA.-DIMETHYLBENZYL ISOCYANATE

Systematic Name

English

3-ISOPROPENYL-.ALPHA.,.ALPHA.'-DIMETHYLBENZYL ISOCYANATE

Preferred Name

English

3-ISOPROPENYLCUMYL ISOCYANATE

Systematic Name

English

M-ISOPROPENYLCUMYL ISOCYANATE

Systematic Name

English

1-(1-ISOCYANATO-1-METHYLETHYL)-3-(1-METHYLETHENYL)BENZENE

Systematic Name

English

.ALPHA.,.ALPHA.-DIMETHYL-M-ISOPROPENYLBENZYL ISOCYANATE

Systematic Name

English

ISOCYANIC ACID, M-ISOPROPENYL-.ALPHA.,.ALPHA.-DIMETHYLBENZYL ESTER

Common Name

English

1-(1-ISOCYANATO-1-METHYLETHYL)-3-ISOPROPENYLBENZENE

Systematic Name

English

1-(2-ISOCYANATOPROPAN-2-YL)-3-(PROP-1-EN-2-YL)BENZENE

Systematic Name

English

DIMETHYL-M-ISOPROPENYLBENZYL ISOCYANATE

Systematic Name

English

BENZENE, 1-(1-ISOCYANATO-1-METHYLETHYL)-3-(1-METHYLETHENYL)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID9044871

Created by admin on Mon Mar 31 19:17:32 GMT 2025 , Edited by admin on Mon Mar 31 19:17:32 GMT 2025

PRIMARY

FDA UNII

RY29G3V80M

Created by admin on Mon Mar 31 19:17:32 GMT 2025 , Edited by admin on Mon Mar 31 19:17:32 GMT 2025

PRIMARY

PUBCHEM

604152

Created by admin on Mon Mar 31 19:17:32 GMT 2025 , Edited by admin on Mon Mar 31 19:17:32 GMT 2025

PRIMARY

CAS

2094-99-7

Created by admin on Mon Mar 31 19:17:32 GMT 2025 , Edited by admin on Mon Mar 31 19:17:32 GMT 2025

PRIMARY

SUBSTANCE RECORD


					RY29G3V80M

3-ISOPROPENYL-.ALPHA.,.ALPHA.-DIMETHYLBENZYL ISOCYANATE