4-(2,5-dimethylphenyl)-4-azatricyclo[5.2.2.0²,?]undec-8-ene-3,5-dione

4-(2,5-dimethylphenyl)-4-azatricyclo[5.2.2.0²,?]undec-8-ene-3,5-dione

Formula: C18H19NO2

SMILES: CC1=CC=C(C)C(=C1)N1C(=O)C2C(C3CCC2C=C3)C1=O

IUPAC: 4-(2,5-dimethylphenyl)-4-azatricyclo[5.2.2.0²,?]undec-8-ene-3,5-dione

InChI: InChI=1/C18H19NO2/c1-10-3-4-11(2)14(9-10)19-17(20)15-12-5-6-13(8-7-12)16(15)18(19)21/h3-6,9,12-13,15-16H,7-8H2,1-2H3

Composition: C (76.84%), H (6.81%), N (4.98%), O (11.37%)

Molar Mass: 281.355

Atom Count: 40

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	4
Exact Mass	281.141578856
Formal Charge	0
FSP3	0.44
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CTCQPEXAXPGKMY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	82
Topological Polar Surface Area	37.38
Polarizability	31.11
Ring Count	4
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H19NO2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00