1,2,3-trimethoxy-5-nitrobenzene

1,2,3-trimethoxy-5-nitrobenzene

CAS: 6307-90-0

Formula: C9H11NO5

SMILES: COC1=CC(=CC(OC)=C1OC)[N+]([O-])=O

IUPAC: 1,2,3-trimethoxy-5-nitrobenzene

InChI: InChI=1S/C9H11NO5/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3/h4-5H,1-3H3

Composition: C (50.71%), H (5.20%), N (6.57%), O (37.52%)

Molar Mass: 213.189

Atom Count: 26

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	213.063722458
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	HZXMMBPRQGKMSW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.77
Topological Polar Surface Area	70.83
Polarizability	19.86
Ring Count	1
Rotatable Bond Count	4

Suppliers

Kinentia Biosciences LLC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<14 Days	6307-90-0		$453.60-$1,701.00$453.60$1,701.00