AG0025PQ

1780-38-7 | Pyrimidine, 2,4,6-trichloro-5-ethyl-

AG0025PQ

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CAS Number	1780-38-7
Catalog Number	AG0025PQ(AGN-PC-0JOL6G)
Chemical Name	Pyrimidine, 2,4,6-trichloro-5-ethyl-
IUPAC Name	2,4,6-trichloro-5-ethylpyrimidine
InChI	InChI=1S/C6H5Cl3N2/c1-2-3-4(7)10-6(9)11-5(3)8/h2H2,1H3
InChI Key	KMPDRUUXTSYMJD-UHFFFAOYSA-N
MDL Number	MFCD11112097
Molecular Formula	C6H5Cl3N2
Molecular Weight	211.4763
NSC Number	67799
SMILES	CCC1=C(Cl)N=C(Cl)N=C1Cl
Synonyms	2,4,6-trichloro-5-ethylpyrimidine, 1780-38-7, Pyrimidine, 2,4,6-trichloro-5-ethyl-, 2,4,6-Trichloro-5-ethyl-pyrimidine, NSC67799, PubChem22004, AC1L6OI6, SCHEMBL501823, CHEMBL1993963, CTK6D0788, DTXSID20290289, KMPDRUUXTSYMJD-UHFFFAOYSA-N, ZINC1694667, Pyrimidine,4,6-trichloro-5-ethyl-, CT-847, NSC-67799, ACM1780387, FCH1402851, AJ-30257, AK122306, NCI60_027874, 2,4,6-tris(chloranyl)-5-ethyl-pyrimidine, AX8149830, Y3182, A812337, C6H5Cl3N2, CID249455,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	209.952g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	211.47g/mol
Monoisotopic Mass	209.952g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	25.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

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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