AG003483

63810-78-6 | 5-Bromo-4-chloro-2-(methylthio)pyrimidine

AG003483

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CAS Number	63810-78-6
Catalog Number	AG003483(AGN-PC-0JNZJN)
Chemical Name	5-Bromo-4-chloro-2-(methylthio)pyrimidine
IUPAC Name	5-bromo-4-chloro-2-methylsulfanylpyrimidine
InChI	InChI=1S/C5H4BrClN2S/c1-10-5-8-2-3(6)4(7)9-5/h2H,1H3
InChI Key	XVRYJQACDDVZEI-UHFFFAOYSA-N
MDL Number	MFCD00023232
Molecular Formula	C5H4BrClN2S
Molecular Weight	239.5207
NSC Number	102496
SMILES	C1=C(C(=NC(=N1)SC)Cl)Br
Synonyms	5-bromo-4-chloro-2-(methylthio)pyrimidine, 63810-78-6, 5-bromo-4-chloro-2-(methylsulfanyl)pyrimidine, 5-BROMO-4-CHLORO-2-METHYLSULFANYL-PYRIMIDINE, 5-Bromo-4-chloro-2-methylsulfanylpyrimidine, 5-BROMO-4-CHLORO-2-METHYLTHIOPYRIMIDINE, AK-39335, PYRIMIDINE, 5-BROMO-4-CHLORO-2-(METHYLTHIO)-, NSC102496, AC1L6EXB, AC1Q3PWL, AC1Q4H3O, KSC356M1J, SCHEMBL6524904, CTK2F6614, DTXSID40295514, XVRYJQACDDVZEI-UHFFFAOYSA-N, WT642, ZINC394674, ACT08539, CS-D1625, KS-000003DD, ANW-50916, MFCD00023232, AKOS015833954, FCH1329164, HP21483, MCULE-7119690233, NSC-102496, PB10049, RP08386, TRA0067447, 2-methylthio-4-chloro-5-bromopyrimidine, AC-28078, AJ-21412, BC671475, BR-39335, CJ-03625, DS-13155, HC210547, OR345386, QC-10223, SC-45089, SY009011, AB0025986, AB1011665, AX8159369, ST2411844, TR-032233, 4CH-008210, 5-Bromo-4-chloro-2-(methylthio);pyrimidine, AM20100575, B4406, FT-0684791, W7562, C-8789, MFCD00023232 (97+%), J-517072, 63810-78-6 5-bromo-4-chloro-2-methylsulfanyl-pyrimidine, null, C5H4BrClN2S, AR-1G7448, CID265881, ACN-051806, 5-bromo-4-chloro-2-(methylthio)-Pyrimidine, 5-Bromo-4-chloro-2-(methylthio)pyrimidine, 97% - 1G 1g, 63992-43-8,

Complexity	116
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	237.897g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	239.515g/mol
Monoisotopic Mass	237.897g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	51.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code	UN 3263

Certificate of Analysis

Lot Number