Aldicarb Sulfone

CAT: 1596-AR-A05869-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-A05869-01Size:10 Units

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CAS Number

1646-88-4

Molecular Formula

C7H14N2O4S

Molecular Weight

222.2590

API Name

Aldicarb sulfone

Chemical Information

Aldicarb sulfone

Aldicarb sulfone is a white crystalline solid. Insecticide.

CAS Number	1646-88-4
PubChem CID	15438
IUPAC Name	[(2-methyl-2-methylsulfonylpropylidene)amino] N-methylcarbamate
Molecular Formula	C7H14N2O4S
Molecular Weight	222.26
XLogP	-0.6
Topological Polar Surface Area	93.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	14
Formal Charge	0
Complexity	326

SMILES

CC(C)(C=NOC(=O)NC)S(=O)(=O)C

InChI

InChI=1S/C7H14N2O4S/c1-7(2,14(4,11)12)5-9-13-6(10)8-3/h5H,1-4H3,(H,8,10)

InChIKey

YRRKLBAKDXSTNC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1646-88-4

CID: 15438

Formula: C7H14N2O4S

MW: 222.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	222.26
XLogP3	-0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	222.06742811
Monoisotopic Mass	222.06742811
Topological Polar Surface Area	93.2 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	326
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes