Malathion

CAT: 0926-FM24974-03Size: 0.5 gDry Ice: NoHazardous: No

1 / 1

CAT#:0926-FM24974-03Size:0.5 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

121-75-5

Synonyms

[ (Dimethoxyphosphinothioyl) thio]butanedioic acid diethyl ester

MDL Number

MFCD00036233

Smiles

CCOC (=O) CC (C (=O) OCC) SP (=S) (OC) OC

Molecular Formula

C10H19O6PS2

Molecular Weight

330.36 g/mol

Controlled

Chemical Information

Malathion

Malathion can cause cancer according to California Labor Code.

CAS Number	121-75-5
PubChem CID	4004
IUPAC Name	diethyl 2-dimethoxyphosphinothioylsulfanylbutanedioate
Molecular Formula	C10H19O6PS2
Molecular Weight	330.4
XLogP	2.4
Topological Polar Surface Area	128
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	11
Heavy Atom Count	19
Formal Charge	0
Complexity	341

SMILES

CCOC(=O)CC(C(=O)OCC)SP(=S)(OC)OC

InChI

InChI=1S/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3

InChIKey

JXSJBGJIGXNWCI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 121-75-5

CID: 4004

Formula: C10H19O6PS2

MW: 330.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	330.4
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	11
Exact Mass	330.03606767
Monoisotopic Mass	330.03606767
Topological Polar Surface Area	128 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	341
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes