N-[2-(cyclohex-1-en-1-yl)ethyl]-2,4-dinitroaniline

N-[2-(cyclohex-1-en-1-yl)ethyl]-2,4-dinitroaniline

Formula: C14H17N3O4

SMILES: [O-][N+](=O)C1=CC=C(NCCC2=CCCCC2)C(=C1)[N+]([O-])=O

IUPAC: N-[2-(cyclohex-1-en-1-yl)ethyl]-2,4-dinitroaniline

InChI: InChI=1S/C14H17N3O4/c18-16(19)12-6-7-13(14(10-12)17(20)21)15-9-8-11-4-2-1-3-5-11/h4,6-7,10,15H,1-3,5,8-9H2

Composition: C (57.72%), H (5.88%), N (14.42%), O (21.97%)

Molar Mass: 291.307

Atom Count: 38

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	291.121906039
Formal Charge	0
FSP3	0.43
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	JIQGDZIFVHNNPF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.17
Topological Polar Surface Area	98.31
Polarizability	29.01
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H17N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00