6-chloro-N-(2,2-dimethoxyethyl)pyrimidin-4-amine

6-chloro-N-(2,2-dimethoxyethyl)pyrimidin-4-amine

CAS: 1159822-73-7

Formula: C8H12ClN3O2

SMILES: COC(CNC1=CC(Cl)=NC=N1)OC

IUPAC: 6-chloro-N-(2,2-dimethoxyethyl)pyrimidin-4-amine

InChI: InChI=1S/C8H12ClN3O2/c1-13-8(14-2)4-10-7-3-6(9)11-5-12-7/h3,5,8H,4H2,1-2H3,(H,10,11,12)

Composition: C (44.15%), H (5.56%), Cl (16.29%), N (19.31%), O (14.70%)

Molar Mass: 217.65

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	217.0618043
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	RITZCZHXWUGXCP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.92
Topological Polar Surface Area	56.27
Polarizability	20.46
Ring Count	1
Rotatable Bond Count	5

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96%	<2 Days	1159822-73-7		$112.70-$2,162.00$112.70$126.50$143.75$172.50$517.50$2,162.00