Products for Research Use Only
RegisterLogin

CL52069

CAT: 0931-T27039-01Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T27039-01Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
14371-55-2
Target
Others
Related Pathways
Others
Bioactivity
CL52069 is an insecticide.
Smiles
COP(=S)(OC)N=C1OCCS1 |w:6.5|
Molecular Formula
C5H10NO3PS2
Molecular Weight
227.23
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

CL-52069
CAS Number14371-55-2
PubChem CID9576712
IUPAC Name(E)-N-dimethoxyphosphinothioyl-1,3-oxathiolan-2-imine
Molecular FormulaC5H10NO3PS2
Molecular Weight227.2
XLogP2.3
Topological Polar Surface Area97.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity225
SMILES
COP(=S)(/N=C/1\OCCS1)OC
InChI
InChI=1S/C5H10NO3PS2/c1-7-10(11,8-2)6-5-9-3-4-12-5/h3-4H2,1-2H3/b6-5+
InChIKey
ZXSAZCMRKXDRJV-AATRIKPKSA-N
Chemical Structure
2D Structure
2D structure of CL-52069
CAS: 14371-55-2
CID: 9576712
Formula: C5H10NO3PS2
MW: 227.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight227.2
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass226.98397253
Monoisotopic Mass226.98397253
Topological Polar Surface Area97.4 Ų
Heavy Atom Count12
Formal Charge0
Complexity225
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19197882-01CL52069

Popular Products