AG001INE

14394-56-0 | 4-Pyrimidinamine, 6-chloro-5-methyl-

AG001INE

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CAS Number	14394-56-0
Catalog Number	AG001INE(AGN-PC-03HXXG)
Chemical Name	4-Pyrimidinamine, 6-chloro-5-methyl-
IUPAC Name	6-chloro-5-methylpyrimidin-4-amine
InChI	InChI=1S/C5H6ClN3/c1-3-4(6)8-2-9-5(3)7/h2H,1H3,(H2,7,8,9)
InChI Key	JCIGQYDCSFFHPI-UHFFFAOYSA-N
MDL Number	MFCD09991585
Molecular Formula	C5H6ClN3
Molecular Weight	143.5742
SMILES	CC1=C(Cl)N=CN=C1N
Synonyms	14394-56-0, 4-Amino-6-chloro-5-methylpyrimidine, 6-chloro-5-methylpyrimidin-4-amine, 6-Amino-4-chloro-5-methylpyrimidine, 4-Pyrimidinamine, 6-chloro-5-methyl-, 6-chloro-5-methyl-4-pyrimidinamine, 6-Chloro-5-methyl-pyrimidin-4-ylamine, PubChem13451, 4-Pyrimidinamine, 6-chloro-5-methyl- (9CI), SCHEMBL179568, CTK0H3718, DTXSID10620319, JCIGQYDCSFFHPI-UHFFFAOYSA-N, ACT04901, ACT08637, ANW-48468, MFCD09991585, ZINC16696902, 4-Pyrimidinamine,6-chloro-5-methyl-, AKOS013039011, QC-5582, SB16105, 6-chloranyl-5-methyl-pyrimidin-4-amine, AJ-69192, AK-27282, BC676733, BR-27282, DS-11199, AB0005155, ST2411098, TC-137213, CS-0045790, FT-0630007, W3135, S-4382, A808141, I03-0206, C5H6ClN3, ACN-051619,

Complexity	98.2
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.025g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	143.574g/mol
Monoisotopic Mass	143.025g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	51.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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