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Details

Stereochemistry RACEMIC
Molecular Formula C10H13Cl
Molecular Weight 168.663
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(1-Chloroethyl)-1,4-dimethylbenzene

SMILES

CC(Cl)C1=C(C)C=CC(C)=C1

InChI

InChIKey=ZPBVKSBGMQFLMA-UHFFFAOYSA-N
InChI=1S/C10H13Cl/c1-7-4-5-8(2)10(6-7)9(3)11/h4-6,9H,1-3H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
2-(1-Chloroethyl)-1,4-dimethylbenzene
Systematic Name English
Benzene, 2-(1-chloroethyl)-1,4-dimethyl-
Systematic Name English
Code System Code Type Description
PUBCHEM
93700
Created by admin on Sat Dec 16 19:07:53 GMT 2023 , Edited by admin on Sat Dec 16 19:07:53 GMT 2023
PRIMARY
FDA UNII
63SCF4S9YV
Created by admin on Sat Dec 16 19:07:53 GMT 2023 , Edited by admin on Sat Dec 16 19:07:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID80973061
Created by admin on Sat Dec 16 19:07:53 GMT 2023 , Edited by admin on Sat Dec 16 19:07:53 GMT 2023
PRIMARY
CAS
57527-74-9
Created by admin on Sat Dec 16 19:07:53 GMT 2023 , Edited by admin on Sat Dec 16 19:07:53 GMT 2023
PRIMARY
NIH
NCATS
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