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ethyl 3-ethoxybenzoate

ethyl 3-ethoxybenzoate

CAS: 5432-17-7

Formula: C11H14O3

SMILES: CCOC(=O)C1=CC(OCC)=CC=C1

IUPAC: ethyl 3-ethoxybenzoate

InChI: InChI=1S/C11H14O3/c1-3-13-10-7-5-6-9(8-10)11(12)14-4-2/h5-8H,3-4H2,1-2H3

Composition: C (68.02%), H (7.27%), O (24.71%)

Molar Mass: 194.23

Atom Count: 28

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 194.094294311
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey BQXRZUDSLFBQDX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.04
Topological Polar Surface Area 35.53
Polarizability 20.95
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 5432-17-7 $12.65-$479.55$12.65$42.55$138.00$479.55
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