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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H18O2
Molecular Weight 146.2273
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-BUTOXY-2-METHYL-2-PROPANOL

SMILES

CCCCOCC(C)(C)O

InChI

InChIKey=JCALRHVFTLBTOZ-UHFFFAOYSA-N
InChI=1S/C8H18O2/c1-4-5-6-10-7-8(2,3)9/h9H,4-7H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
1-BUTOXY-2-METHYLPROPAN-2-OL
Preferred Name English
1-BUTOXY-2-METHYL-2-PROPANOL
Systematic Name English
2-PROPANOL, 1-BUTOXY-2-METHYL-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
222-722-7
Created by admin on Wed Apr 02 12:27:30 GMT 2025 , Edited by admin on Wed Apr 02 12:27:30 GMT 2025
PRIMARY
FDA UNII
RB5L5S4WMB
Created by admin on Wed Apr 02 12:27:30 GMT 2025 , Edited by admin on Wed Apr 02 12:27:30 GMT 2025
PRIMARY
PUBCHEM
77138
Created by admin on Wed Apr 02 12:27:30 GMT 2025 , Edited by admin on Wed Apr 02 12:27:30 GMT 2025
PRIMARY
CAS
3587-69-7
Created by admin on Wed Apr 02 12:27:30 GMT 2025 , Edited by admin on Wed Apr 02 12:27:30 GMT 2025
PRIMARY
EPA CompTox
DTXSID00189420
Created by admin on Wed Apr 02 12:27:30 GMT 2025 , Edited by admin on Wed Apr 02 12:27:30 GMT 2025
PRIMARY