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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H8
Molecular Weight 68.117
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYLBUTA-1,2-DIENE

SMILES

CC(C)=C=C

InChI

InChIKey=PAKGDPSCXSUALC-UHFFFAOYSA-N
InChI=1S/C5H8/c1-4-5(2)3/h1H2,2-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-74117
Preferred Name English
3-METHYLBUTA-1,2-DIENE
Systematic Name English
1,1-DIMETHYLALLENE
Systematic Name English
1,1-DIMETHYLPROPADIENE
Systematic Name English
3,3-DIMETHYLALLENE
Systematic Name English
3-METHYL-1,2-BUTADIENE
Systematic Name English
1,2-BUTADIENE, 3-METHYL-
Systematic Name English
2-METHYL-2,3-BUTADIENE
Systematic Name English
1,1-DIMETHYLALLYLENE
Systematic Name English
Code System Code Type Description
FDA UNII
NQO612O389
Created by admin on Tue Apr 01 18:52:28 GMT 2025 , Edited by admin on Tue Apr 01 18:52:28 GMT 2025
PRIMARY
ECHA (EC/EINECS)
209-926-1
Created by admin on Tue Apr 01 18:52:28 GMT 2025 , Edited by admin on Tue Apr 01 18:52:28 GMT 2025
PRIMARY
NSC
74117
Created by admin on Tue Apr 01 18:52:28 GMT 2025 , Edited by admin on Tue Apr 01 18:52:28 GMT 2025
PRIMARY
PUBCHEM
11714
Created by admin on Tue Apr 01 18:52:28 GMT 2025 , Edited by admin on Tue Apr 01 18:52:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID00208529
Created by admin on Tue Apr 01 18:52:28 GMT 2025 , Edited by admin on Tue Apr 01 18:52:28 GMT 2025
PRIMARY
CAS
598-25-4
Created by admin on Tue Apr 01 18:52:28 GMT 2025 , Edited by admin on Tue Apr 01 18:52:28 GMT 2025
PRIMARY