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Metolachlor-d6 (propyl-d6)

CAT: 0931-TMIJ-0469-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TMIJ-0469-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1219803-97-0
Bioactivity
Metolachlor-d6 (propyl-d6) is a deuterated compound of Metolachlor. Metolachlor has a CAS number of 51218-45-2. Metolachlor is an organic compound. Metolachlor is also widely used as an herbicide.
Smiles
ClCC(N(C1=C(C=CC=C1CC)C)C([2H])(C([2H])([2H])[2H])C([2H])([2H])OC)=O
Molecular Formula
C15H16D6ClNO2
Molecular Weight
289.83
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Metolachlor-d6
CAS Number1219803-97-0
PubChem CID71750717
IUPAC Name2-chloro-N-(2-ethyl-6-methylphenyl)-N-(1,1,1,2,3,3-hexadeuterio-3-methoxypropan-2-yl)acetamide
Molecular FormulaC15H22ClNO2
Molecular Weight289.83
XLogP3.1
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count19
Formal Charge0
Complexity285
SMILES
[2H]C([2H])([2H])C([2H])(C([2H])([2H])OC)N(C1=C(C=CC=C1CC)C)C(=O)CCl
InChI
InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3/i3D3,10D2,12D
InChIKey
WVQBLGZPHOPPFO-XCPSXBTFSA-N
Chemical Structure
2D Structure
2D structure of Metolachlor-d6
CAS: 1219803-97-0
CID: 71750717
Formula: C15H22ClNO2
MW: 289.83
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight289.83
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass289.1715671
Monoisotopic Mass289.1715671
Topological Polar Surface Area29.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity285
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-M338702-100MGMetolachlor-d6
HY-W714694Metolachlor ESA Sodium Salt-d6
TRC-M338862-2.5MGMetolachlor ESA-d6 Sodium Salt
AR-A06176-01Iso-Propyl-d6-amine
MBS6071728-01Verapamil-d6 Hydrochloride (a-[3-[[2-(3,4-Dimethoxyphenyl)ethyl]methylamino]propyl]-3,4-dimethoxy-a-(1-methylethyl)-benzeneacetonitrile-d6 Hydrochloride, Berkatens-d6, Calan-d6, Cardibeltin-d6, Dignover-d6, Isoptin-d6, Veracim-d6, Veramex-d6, Zolvera-d6)
HY-W741882-017-[2-Hydroxy (propyl-d6) ]guanine
HY-W739664-019-[2- (Diethylphosphonomethoxy) propyl-d6] adenine
TRC-D444752-1MG9-[2-(Diethylphosphonomethoxy)propyl-d6] Adenine
MBS6085225-017-[2-Hydroxy(propyl-d6)]guanine
sc-499058[3- (Dimethylamino) propyl]triphenylphosphonium-d6 bromide

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