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ethyl 2,5-dimethoxy-4-nitrobenzoate

ethyl 2,5-dimethoxy-4-nitrobenzoate

Formula: C11H13NO6

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

IUPAC: ethyl 2,5-dimethoxy-4-nitrobenzoate

InChI: InChI=1S/C11H13NO6/c1-4-18-11(13)7-5-10(17-3)8(12(14)15)6-9(7)16-2/h5-6H,4H2,1-3H3

Composition: C (51.77%), H (5.13%), N (5.49%), O (37.61%)

Molar Mass: 255.226

Atom Count: 31

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 255.074287143
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey GKXUCJSHAMOYEY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.08
Topological Polar Surface Area 87.9
Polarizability 23.64
Ring Count 1
Rotatable Bond Count 6

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C11H13NO6 $1,760.00-$3,520.00$1,760.00$2,750.00$3,520.00
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