6-iodo-7-methyl-1H,2H,3H-pyrido[2,3-b][1,4]oxazine

6-iodo-7-methyl-1H,2H,3H-pyrido[2,3-b][1,4]oxazine

CAS: 1261365-45-0

Formula: C8H9IN2O

SMILES: CC1=CC2=C(OCCN2)N=C1I

IUPAC: 6-iodo-7-methyl-1H,2H,3H-pyrido[2,3-b][1,4]oxazine

InChI: InChI=1S/C8H9IN2O/c1-5-4-6-8(11-7(5)9)12-3-2-10-6/h4,10H,2-3H2,1H3

Composition: C (34.80%), H (3.29%), I (45.97%), N (10.15%), O (5.80%)

Molar Mass: 276.077

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	275.97596
Formal Charge	0
FSP3	0.37
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	URBOWKKGCCRBSG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.01
Topological Polar Surface Area	34.15
Polarizability	21.32
Ring Count	2
Rotatable Bond Count	0

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