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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12
Molecular Weight 132.2023
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-ALLYLTOLUENE

SMILES

CC1=CC=C(CC=C)C=C1

InChI

InChIKey=WAEOXIOXMKNFLQ-UHFFFAOYSA-N
InChI=1S/C10H12/c1-3-4-10-7-5-9(2)6-8-10/h3,5-8H,1,4H2,2H3

HIDE SMILES / InChI

Molecular Formula C10H12
Molecular Weight 132.2023
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 10:03:10 GMT 2023
Edited
by admin
on Sat Dec 16 10:03:10 GMT 2023
Record UNII
8YYQ7W3Z76
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-ALLYLTOLUENE
Common Name English
NSC-73971
Code English
1-METHYL-4-(PROP-2-EN-1-YL)BENZENE
Systematic Name English
4-ISOPROPENYLTOLUENE
Systematic Name English
BENZENE, 1-METHYL-4-(2-PROPEN-1-YL)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
222-063-5
Created by admin on Sat Dec 16 10:03:10 GMT 2023 , Edited by admin on Sat Dec 16 10:03:10 GMT 2023
PRIMARY
PUBCHEM
76851
Created by admin on Sat Dec 16 10:03:10 GMT 2023 , Edited by admin on Sat Dec 16 10:03:10 GMT 2023
PRIMARY
NSC
73971
Created by admin on Sat Dec 16 10:03:10 GMT 2023 , Edited by admin on Sat Dec 16 10:03:10 GMT 2023
PRIMARY
CAS
3333-13-9
Created by admin on Sat Dec 16 10:03:10 GMT 2023 , Edited by admin on Sat Dec 16 10:03:10 GMT 2023
PRIMARY
EPA CompTox
DTXSID4062983
Created by admin on Sat Dec 16 10:03:10 GMT 2023 , Edited by admin on Sat Dec 16 10:03:10 GMT 2023
PRIMARY
FDA UNII
8YYQ7W3Z76
Created by admin on Sat Dec 16 10:03:10 GMT 2023 , Edited by admin on Sat Dec 16 10:03:10 GMT 2023
PRIMARY
Related Record Type Details
METABOLITE -> PARENT