AG003MKE

433684-23-2 | 5-Bromo-2-(diethylamino)pyrimidine

AG003MKE

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CAS Number	433684-23-2
Catalog Number	AG003MKE(AGN-PC-0LOCQJ)
Chemical Name	5-Bromo-2-(diethylamino)pyrimidine
IUPAC Name	5-bromo-N,N-diethylpyrimidin-2-amine
InChI	InChI=1S/C8H12BrN3/c1-3-12(4-2)8-10-5-7(9)6-11-8/h5-6H,3-4H2,1-2H3
InChI Key	AKTJBOBIMUJVHD-UHFFFAOYSA-N
MDL Number	MFCD03646011
Molecular Formula	C8H12BrN3
Molecular Weight	230.1050
SMILES	CCN(CC)C1=NC=C(Br)C=N1
Synonyms	5-bromo-N,N-diethylpyrimidin-2-amine, 433684-23-2, 5-BROMO-2-(DIETHYLAMINO)PYRIMIDINE, ACMC-1APZH, AC1NPA7M, SCHEMBL5238211, CTK4I7277, DTXSID70409485, AKTJBOBIMUJVHD-UHFFFAOYSA-N, HMS1631G15, ZINC1495461, ANW-29978, MFCD03646011, AKOS013188324, AB15626, AM86966, CCG-141763, RTR-016836, 2-(N,N-diethylamino)-5-bromopyrimidine, AJ-26386, DB-070427, TR-016836, FT-0754321, ST24044525, Z0592, B-3488, (5-BROMO-PYRIMIDIN-2-YL)-DIETHYL-AMINE, I03-753, C8H12BrN3, CID5200730, 5-bromo-N,N-diethyl-pyrimidin-2-amine,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.021g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	230.109g/mol
Monoisotopic Mass	229.021g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	29A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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