N-(3-chloro-4-methylphenyl)-2H-1,3-benzodioxole-5-carboxamide

N-(3-chloro-4-methylphenyl)-2H-1,3-benzodioxole-5-carboxamide

Formula: C15H12ClNO3

SMILES: CC1=CC=C(NC(=O)C2=CC=C3OCOC3=C2)C=C1Cl

IUPAC: N-(3-chloro-4-methylphenyl)-2H-1,3-benzodioxole-5-carboxamide

InChI: InChI=1S/C15H12ClNO3/c1-9-2-4-11(7-12(9)16)17-15(18)10-3-5-13-14(6-10)20-8-19-13/h2-7H,8H2,1H3,(H,17,18)

Composition: C (62.19%), H (4.18%), Cl (12.24%), N (4.83%), O (16.57%)

Molar Mass: 289.72

Atom Count: 32

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	289.050571
Formal Charge	0
FSP3	0.13
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	OGCVGDICTLSPMO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.2
Topological Polar Surface Area	47.56
Polarizability	29.06
Ring Count	3
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H12ClNO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00