N-benzyl-3-fluoroaniline

N-benzyl-3-fluoroaniline

CAS: 123330-53-0

Formula: C13H12FN

SMILES: FC1=CC=CC(NCC2=CC=CC=C2)=C1

IUPAC: N-benzyl-3-fluoroaniline

InChI: InChI=1S/C13H12FN/c14-12-7-4-8-13(9-12)15-10-11-5-2-1-3-6-11/h1-9,15H,10H2

Composition: C (77.59%), H (6.01%), F (9.44%), N (6.96%)

Molar Mass: 201.244

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	201.095377553
Formal Charge	0
FSP3	0.08
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	UAOKRESMHSOHJL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.08
Topological Polar Surface Area	12.03
Polarizability	22.55
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	123330-53-0		$2,420.00-$3,740.00$2,420.00$3,740.00