2-chloro-N4,6-dimethylpyrimidine-4,5-diamine

2-chloro-N4,6-dimethylpyrimidine-4,5-diamine

CAS: 5176-95-4

Formula: C6H9ClN4

SMILES: CNC1=NC(Cl)=NC(C)=C1N

IUPAC: 2-chloro-N4,6-dimethylpyrimidine-4,5-diamine

InChI: InChI=1S/C6H9ClN4/c1-3-4(8)5(9-2)11-6(7)10-3/h8H2,1-2H3,(H,9,10,11)

Composition: C (41.75%), H (5.26%), Cl (20.54%), N (32.46%)

Molar Mass: 172.62

Atom Count: 20

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	172.051574
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	GRKBHWUDUVHOQC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.02
Topological Polar Surface Area	63.83
Polarizability	16.47
Ring Count	1
Rotatable Bond Count	1

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