4-amino-2,5-difluorobenzonitrile

4-amino-2,5-difluorobenzonitrile

CAS: 112279-61-5

Formula: C7H4F2N2

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

IUPAC: 4-amino-2,5-difluorobenzonitrile

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