Tetrasul

CAT: 0607-BA2229-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0607-BA2229-50Size:50 mg

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Description

Tetrasul is an acaricide, Tetrasul suppresses the two-spotted leaf mite and aphids on hops.

CAS Number

2227-13-6

Molecular Formula

C12H6Cl4S

Molecular Weight

324.05

Storage Conditions

-20°C

Chemical Information

Tetrasul

Tetrasul is an organochlorine compound.

CAS Number	2227-13-6
PubChem CID	16685
IUPAC Name	1,2,4-trichloro-5-(4-chlorophenyl)sulfanylbenzene
Molecular Formula	C12H6Cl4S
Molecular Weight	324.0
XLogP	6.5
Topological Polar Surface Area	25.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	17
Formal Charge	0
Complexity	243

SMILES

C1=CC(=CC=C1SC2=CC(=C(C=C2Cl)Cl)Cl)Cl

InChI

InChI=1S/C12H6Cl4S/c13-7-1-3-8(4-2-7)17-12-6-10(15)9(14)5-11(12)16/h1-6H

InChIKey

QUWSDLYBOVGOCW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2227-13-6

CID: 16685

Formula: C12H6Cl4S

MW: 324.0

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	324.0
XLogP3	6.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	323.891482
Monoisotopic Mass	321.894432
Topological Polar Surface Area	25.3 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	243
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
B6254-10	(RS) - (Tetrazol-5-yl) glycine
B6254-50	(RS) - (Tetrazol-5-yl) glycine