AG003MZV

29529-99-5 | 6-(DIBUTYLAMINO)-1,3,5-TRIAZINE-2,4-DITHIOL

AG003MZV

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CAS Number	29529-99-5
Catalog Number	AG003MZV(AGN-PC-0KO79S)
Chemical Name	6-(DIBUTYLAMINO)-1,3,5-TRIAZINE-2,4-DITHIOL
EC Number	249-682-3
IUPAC Name	6-(dibutylamino)-1H-1,3,5-triazine-2,4-dithione
InChI	InChI=1S/C11H20N4S2/c1-3-5-7-15(8-6-4-2)9-12-10(16)14-11(17)13-9/h3-8H2,1-2H3,(H2,12,13,14,16,17)
InChI Key	IXDGHAZCSMVIFX-UHFFFAOYSA-N
MDL Number	MFCD00272594
Molecular Formula	C11H20N4S2
Molecular Weight	272.4333
SMILES	S=C(N1)NC(N(CCCC)CCCC)=NC1=S
Synonyms	29529-99-5, 6-(Dibutylamino)-1,3,5-triazine-2,4-dithiol, 1,3,5-Triazine-2,4(1H,3H)-dithione, 6-(dibutylamino)-, 1,3,5-Triazine-2,4(1H,3H)-dithione,6-(dibutylamino)-, 6-(dibutylamino)-1H-1,3,5-triazine-2,4-dithione, EINECS 249-682-3, Zisnet DB, ACMC-1CAPX, AC1MHZ7Y, SCHEMBL396745, DTXSID0067478, CTK4G3443, 6-(Dibutylamino)-1,3,5-triazine-2,4(1H,3H)-dithione, KS-000011TN, ZINC2564432, ANW-26645, MFCD00272594, AKOS027320987, AKOS028108743, TC-115390, 2-dibutylamino-1,3,5-triazine-4,6-dithiol, D3265, 2-(Dibutylamino)-4,6-dimercapto-1,3,5-triazine, A819947, C11H20N4S2, C11-H20-N4-S2, ACN-038036, CID3035346,

Complexity	307
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	272.113g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	272.429g/mol
Monoisotopic Mass	272.113g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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