Trans-Cypermethrin-d6

CAT: 1596-AR-C03852-05Size: 150Dry Ice: NoHazardous: No

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CAT#:1596-AR-C03852-05Size:150

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CAS Number

82523-65-7

Synonyms

(1R,3S) -cyano (3-phenoxyphenyl) methyl 3- (2,2-dichlorovinyl) -2,2-dimethylcyclopropanecarboxylate-D6

Molecular Formula

C22H13D6Cl2NO3

Molecular Weight

422.33

API Name

Cypermethrin

Chemical Information

trans-Cypermethrin D6 (dimethyl D6)

CAS Number	82523-65-7
PubChem CID	92043560
IUPAC Name	[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-bis(trideuteriomethyl)cyclopropane-1-carboxylate
Molecular Formula	C22H19Cl2NO3
Molecular Weight	422.3
XLogP	6
Topological Polar Surface Area	59.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Heavy Atom Count	28
Formal Charge	0
Complexity	643

SMILES

[2H]C([2H])([2H])C1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C([2H])([2H])[2H]

InChI

InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/i1D3,2D3

InChIKey

KAATUXNTWXVJKI-WFGJKAKNSA-N

Chemical Structure

2D Structure

CAS: 82523-65-7

CID: 92043560

Formula: C22H19Cl2NO3

MW: 422.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	422.3
XLogP3	6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Exact Mass	421.1118593
Monoisotopic Mass	421.1118593
Topological Polar Surface Area	59.3 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	643
Isotope Atom Count	6
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-C08774-01	Cypermethrin Impurity 8 (trans, 4 isomers)
AR-O01458-01	Trans-Ormeloxifene-d6
AR-C03850-01	Alpha-Cypermethrin
AR-V01543-01	5,6-trans Calcitriol-d6
AR-C05812-01	Calcitriol EP Impurity A-d6 (5,6-trans Calcitriol-d6)
AR-C08792-01	Cypermethrin Impurity 22
AR-C08784-01	Cypermethrin Impurity 14
AR-C08782-01	Cypermethrin Impurity 12
AR-C08780-01	Cypermethrin Impurity 10
AR-C08791-01	Cypermethrin Impurity 21

Catalog	Name
CS-EJ-00005	Trans-Cypermethrin D6
CS-EJ-0005	Trans-Cypermethrin-d6
TMIJ-0464-01	Trans-Cypermethrin-d6 (dimethyl-d6)
TRC-C989034-25MG	trans-Cypermethrin Benzaldehyde
TRC-C989008-25MG	(1S,aS)-trans-Cypermethrin
CS-T-74056	(1S, aS) -trans-Cypermethrin
412786-01	(1S, αS) -trans-Cypermethrin
TRC-C989008-2.5MG	(1S,AlphaS)-trans-Cypermethrin
TRC-C985250-10MG	(1S,AlphaS)-trans-Cypermethrin (Racemic Mixture)
TMIJ-0462-01	Trans-Permethrin-d6 (dimethyl-d6)