4-amino-2-methoxypyrimidine-5-carbonitrile

4-amino-2-methoxypyrimidine-5-carbonitrile

CAS: 6964-55-2

Formula: C6H6N4O

SMILES: COC1=NC=C(C#N)C(N)=N1

IUPAC: 4-amino-2-methoxypyrimidine-5-carbonitrile

InChI: InChI=1S/C6H6N4O/c1-11-6-9-3-4(2-7)5(8)10-6/h3H,1H3,(H2,8,9,10)

Composition: C (48.00%), H (4.03%), N (37.32%), O (10.66%)

Molar Mass: 150.141

Atom Count: 17

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	150.054160829
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	CXJTWQSCORECON-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.87
Topological Polar Surface Area	84.82
Polarizability	14.1
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	6964-55-2		$400.55-$889.07$400.55$889.07