4-chloro-6-(methoxymethyl)-2-(methylsulfanyl)pyrimidine

4-chloro-6-(methoxymethyl)-2-(methylsulfanyl)pyrimidine

CAS: 1499503-95-5

Formula: C7H9ClN2OS

SMILES: COCC1=CC(Cl)=NC(SC)=N1

IUPAC: 4-chloro-6-(methoxymethyl)-2-(methylsulfanyl)pyrimidine

InChI: InChI=1S/C7H9ClN2OS/c1-11-4-5-3-6(8)10-7(9-5)12-2/h3H,4H2,1-2H3

Composition: C (41.08%), H (4.43%), Cl (17.32%), N (13.69%), O (7.82%), S (15.66%)

Molar Mass: 204.67

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	204.0124118
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	RWBYNJVGRHNTJB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.34
Topological Polar Surface Area	35.01
Polarizability	19.81
Ring Count	1
Rotatable Bond Count	3

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