ethyl 2-methoxy-5-nitrobenzoate

ethyl 2-methoxy-5-nitrobenzoate

CAS: 90923-08-3

Formula: C10H11NO5

SMILES: CCOC(=O)C1=C(OC)C=CC(=C1)[N+]([O-])=O

IUPAC: ethyl 2-methoxy-5-nitrobenzoate

InChI: InChI=1S/C10H11NO5/c1-3-16-10(12)8-6-7(11(13)14)4-5-9(8)15-2/h4-6H,3H2,1-2H3

Composition: C (53.33%), H (4.92%), N (6.22%), O (35.52%)

Molar Mass: 225.2

Atom Count: 27

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	225.063722458
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	LLMJDYSVAYKBJC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.62
Topological Polar Surface Area	78.67
Polarizability	21.08
Ring Count	1
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	90923-08-3		$1,760.00-$3,520.00$1,760.00$2,750.00$3,520.00