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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H10
Molecular Weight 94.1543
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-DIMETHYLCYCLOPENTADIENE

SMILES

CC1=CC(C)=CC1

InChI

InChIKey=YPEOCTSXLWIZSO-UHFFFAOYSA-N
InChI=1S/C7H10/c1-6-3-4-7(2)5-6/h3,5H,4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C7H10
Molecular Weight 94.1543
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:44:59 GMT 2023
Edited
by admin
on Sat Dec 16 14:44:59 GMT 2023
Record UNII
CS9GR8P2I1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-DIMETHYLCYCLOPENTADIENE
Systematic Name English
1,3-DIMETHYL-1,3-CYCLOPENTADIENE
Systematic Name English
1,3-CYCLOPENTADIENE, 1,3-DIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
CS9GR8P2I1
Created by admin on Sat Dec 16 14:44:59 GMT 2023 , Edited by admin on Sat Dec 16 14:44:59 GMT 2023
PRIMARY
CAS
4045-53-8
Created by admin on Sat Dec 16 14:44:59 GMT 2023 , Edited by admin on Sat Dec 16 14:44:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID00456442
Created by admin on Sat Dec 16 14:44:59 GMT 2023 , Edited by admin on Sat Dec 16 14:44:59 GMT 2023
PRIMARY
PUBCHEM
11137094
Created by admin on Sat Dec 16 14:44:59 GMT 2023 , Edited by admin on Sat Dec 16 14:44:59 GMT 2023
PRIMARY