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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5Cl3
Molecular Weight 195.474
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DICHLOROBENZYL CHLORIDE

SMILES

ClCC1=CC(Cl)=C(Cl)C=C1

InChI

InChIKey=YZIFVWOCPGPNHB-UHFFFAOYSA-N
InChI=1S/C7H5Cl3/c8-4-5-1-2-6(9)7(10)3-5/h1-3H,4H2

HIDE SMILES / InChI

Molecular Formula C7H5Cl3
Molecular Weight 195.474
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
One scaffold, three binding modes: novel and selective pteridine reductase 1 inhibitors derived from fragment hits discovered by virtual screening.
2009 Jul 23
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:06:01 UTC 2023
Edited
by admin
on Sat Dec 16 10:06:01 UTC 2023
Record UNII
451PB8SMIE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-DICHLOROBENZYL CHLORIDE
Systematic Name English
3,4-DICHLORO-1-(CHLOROMETHYL)BENZENE
Systematic Name English
3,4,.ALPHA.-TRICHLOROTOLUENE
Systematic Name English
BENZENE, 1,2-DICHLORO-4-(CHLOROMETHYL)-
Systematic Name English
4-CHLOROMETHYL-1,2-DICHLOROBENZENE
Systematic Name English
3,4-DICHLOROPHENYLMETHYL CHLORIDE
Systematic Name English
NSC-406893
Code English
TOLUENE, .ALPHA.,3,4-TRICHLORO-
Systematic Name English
1,2-DICHLORO-4-(CHLOROMETHYL)BENZENE
Systematic Name English
.ALPHA.,3,4-TRICHLOROTOLUENE
Systematic Name English
Code System Code Type Description
FDA UNII
451PB8SMIE
Created by admin on Sat Dec 16 10:06:01 UTC 2023 , Edited by admin on Sat Dec 16 10:06:01 UTC 2023
PRIMARY
EPA CompTox
DTXSID9059252
Created by admin on Sat Dec 16 10:06:01 UTC 2023 , Edited by admin on Sat Dec 16 10:06:01 UTC 2023
PRIMARY
PUBCHEM
7609
Created by admin on Sat Dec 16 10:06:01 UTC 2023 , Edited by admin on Sat Dec 16 10:06:01 UTC 2023
PRIMARY
ECHA (EC/EINECS)
203-033-0
Created by admin on Sat Dec 16 10:06:01 UTC 2023 , Edited by admin on Sat Dec 16 10:06:01 UTC 2023
PRIMARY
NSC
406893
Created by admin on Sat Dec 16 10:06:01 UTC 2023 , Edited by admin on Sat Dec 16 10:06:01 UTC 2023
PRIMARY
CAS
102-47-6
Created by admin on Sat Dec 16 10:06:01 UTC 2023 , Edited by admin on Sat Dec 16 10:06:01 UTC 2023
PRIMARY