5-nitro-N4-(prop-2-en-1-yl)pyrimidine-4,6-diamine

5-nitro-N4-(prop-2-en-1-yl)pyrimidine-4,6-diamine

Formula: C7H9N5O2

SMILES: NC1=NC=NC(NCC=C)=C1[N+]([O-])=O

IUPAC: 5-nitro-N4-(prop-2-en-1-yl)pyrimidine-4,6-diamine

InChI: InChI=1S/C7H9N5O2/c1-2-3-9-7-5(12(13)14)6(8)10-4-11-7/h2,4H,1,3H2,(H3,8,9,10,11)

Composition: C (43.08%), H (4.65%), N (35.88%), O (16.39%)

Molar Mass: 195.182

Atom Count: 23

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	195.07562455
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	GNCICVPPIIKUIX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.73
Topological Polar Surface Area	106.97
Polarizability	18.07
Ring Count	1
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C7H9N5O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00