3-amino-4-fluoro-N-methylbenzamide

3-amino-4-fluoro-N-methylbenzamide

CAS: 639858-50-7

Formula: C8H9FN2O

SMILES: CNC(=O)C1=CC=C(F)C(N)=C1

IUPAC: 3-amino-4-fluoro-N-methylbenzamide

InChI: InChI=1S/C8H9FN2O/c1-11-8(12)5-2-3-6(9)7(10)4-5/h2-4H,10H2,1H3,(H,11,12)

Composition: C (57.14%), H (5.39%), F (11.30%), N (16.66%), O (9.51%)

Molar Mass: 168.171

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	168.069891081
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	QHANKIGJOCDPNG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.95
Topological Polar Surface Area	55.12
Polarizability	15.87
Ring Count	1
Rotatable Bond Count	1

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