5-amino-2,3-difluorobenzonitrile

5-amino-2,3-difluorobenzonitrile

CAS: 1247885-41-1

Formula: C7H4F2N2

SMILES: NC1=CC(F)=C(F)C(=C1)C#N

IUPAC: 5-amino-2,3-difluorobenzonitrile

InChI: InChI=1S/C7H4F2N2/c8-6-2-5(11)1-4(3-10)7(6)9/h1-2H,11H2

Composition: C (54.55%), H (2.62%), F (24.65%), N (18.18%)

Molar Mass: 154.12

Atom Count: 15

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	154.034254463
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	LXNMJONOHNFFBE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.91
Topological Polar Surface Area	49.81
Polarizability	12.79
Ring Count	1
Rotatable Bond Count	0

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