N-Desmethylthiamethoxam, min.98% (HPLC)

Name: N-Desmethylthiamethoxam
Brand: Chempure

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CAS Number

171103-04-1

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IUPAC name	N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-2,6-dihydro-1,3,5-oxadiazin-4-yl]nitramide
inchi	InChI=1S/C7H8ClN5O3S/c8-6-9-1-5(17-6)2-12-4-16-3-10-7(12)11-13(14)15/h1H,2-4H2,(H,10,11)
inchi key	LOXCNVOJGRNBFX-UHFFFAOYSA-N
molecular formula	C7H8ClN5O3S
synonyms	171103-04-1 N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-2,6-dihydro-1,3,5-oxadiazin-4-yl]nitramide 2H-1,3,5-Oxadiazin-4-amine,3-[(2-chloro-5-thiazolyl)methyl]-3,6-dihydro-N-nitro- Thiamethoxam-desmethyl 2H-1,3,5-Oxadiazin-4-amine, 3-[(2-chloro-5-thiazolyl)methyl]-3,6-dihydro-N-nitro-; 3-[(2-Chloro-5-thiazolyl)methyl]-3,6-dihydro-N-nitro-2H-1,3,5-oxadiazin-4-amine; CGA 330050; Desmethylthiamethoxam; N-Desmethylthiamethoxam

Computed Properties

Molecular Weight:	277.69 g/mol
XLogP3:	1
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	6
Rotatable Bond Count:	3
Exact Mass:	277.0036380 Da
Monoisotopic Mass:	277.0036380 Da
Topological Polar Surface Area:	124 Å²
Heavy Atom Count:	17
Formal Charge:	0
Complexity:	325
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Acute Tox. 4 (100%)
precautionary statement codes	P264, P270, P301+P317, P330, and P501
hazard statements	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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Product No: DT8104

N-Desmethylthiamethoxam, min.98% (HPLC)

Product No: DT8104

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