4-(3-chloro-2-methylphenyl)-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-ene-3,5-dione

4-(3-chloro-2-methylphenyl)-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-ene-3,5-dione

Formula: C18H16ClNO2

SMILES: CC1=C(Cl)C=CC=C1N1C(=O)C2C(C3C=CC2C2CC32)C1=O

IUPAC: 4-(3-chloro-2-methylphenyl)-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-ene-3,5-dione

InChI: InChI=1/C18H16ClNO2/c1-8-13(19)3-2-4-14(8)20-17(21)15-9-5-6-10(12-7-11(9)12)16(15)18(20)22/h2-6,9-12,15-16H,7H2,1H3

Composition: C (68.90%), H (5.14%), Cl (11.30%), N (4.46%), O (10.20%)

Molar Mass: 313.78

Atom Count: 38

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	6
Exact Mass	313.0869565
Formal Charge	0
FSP3	0.44
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CXJSEJWMMXJMDC-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	84.46
Topological Polar Surface Area	37.38
Polarizability	32.34
Ring Count	5
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H16ClNO2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00