1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl nitrate

1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl nitrate

Formula: C11H12N2O7

SMILES: CCC(O[N+]([O-])=O)C1=CC2=C(OCCO2)C=C1[N+]([O-])=O

IUPAC: 1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl nitrate

InChI: InChI=1/C11H12N2O7/c1-2-9(20-13(16)17)7-5-10-11(19-4-3-18-10)6-8(7)12(14)15/h5-6,9H,2-4H2,1H3

Composition: C (46.48%), H (4.26%), N (9.86%), O (39.40%)

Molar Mass: 284.224

Atom Count: 32

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	284.064450734
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
InChIKey	WFAWVMCQKPCFFF-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.78
Topological Polar Surface Area	113.97
Polarizability	24.89
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C11H12N2O7		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00