5-fluoro-2H-chromene-3-carbonitrile

5-fluoro-2H-chromene-3-carbonitrile

CAS: 1512308-03-0

Formula: C10H6FNO

SMILES: FC1=C2C=C(COC2=CC=C1)C#N

IUPAC: 5-fluoro-2H-chromene-3-carbonitrile

InChI: InChI=1S/C10H6FNO/c11-9-2-1-3-10-8(9)4-7(5-12)6-13-10/h1-4H,6H2

Composition: C (68.57%), H (3.45%), F (10.85%), N (8.00%), O (9.13%)

Molar Mass: 175.162

Atom Count: 19

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	175.04334198
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	JXNYUJRJDNCUQH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.59
Topological Polar Surface Area	33.02
Polarizability	16.93
Ring Count	2
Rotatable Bond Count	0

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