TERT-BUTYL IODIDE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C4H9I
Molecular Weight	184.0187
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TERT-BUTYL IODIDE

SMILES

CC(C)(C)I

InChI

InChIKey=ANGGPYSFTXVERY-UHFFFAOYSA-N

InChI=1S/C4H9I/c1-4(2,3)5/h1-3H3

HIDE SMILES / InChI

Molecular Formula	C4H9I
Molecular Weight	184.0187
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

PubMed

Show entries

Title	Date	PubMed
CH stretching vibrational overtone spectra of tert-butylbenzene, tert-butyl chloride, and tert-butyl iodide.	2005 May 12	16833730
A direct comparison of reactivity and mechanism in the gas phase and in solution.	2010 Mar 24	20187638

Showing 1 to 2 of 2 entries

Substance Class	Chemical
Record UNII	E5HY19G10P
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

1,1-DIMETHYLETHYL IODIDE

Preferred Name

English

TERT-BUTYL IODIDE

Systematic Name

English

TRIMETHYLIODOMETHANE

Systematic Name

English

PROPANE, 2-IODO-2-METHYL-

Systematic Name

English

BUTYL IODIDE, TERT-

Systematic Name

English

Showing 1 to 5 of 8 entries

Previous1 2Next

Show entries

Code System

Code

Type

Description

FDA UNII

E5HY19G10P

PRIMARY

PUBCHEM

11206

PRIMARY

CAS

558-17-8

PRIMARY

ECHA (EC/EINECS)

209-190-1

PRIMARY

EPA CompTox

DTXSID3060328

PRIMARY

Showing 1 to 5 of 5 entries