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ethyl 3-(1,3-dioxolan-2-ylmethoxy)benzoate

ethyl 3-(1,3-dioxolan-2-ylmethoxy)benzoate

CAS: 850348-88-8

Formula: C13H16O5

SMILES: CCOC(=O)C1=CC=CC(OCC2OCCO2)=C1

IUPAC: ethyl 3-[(1,3-dioxolan-2-yl)methoxy]benzoate

InChI: InChI=1S/C13H16O5/c1-2-15-13(14)10-4-3-5-11(8-10)18-9-12-16-6-7-17-12/h3-5,8,12H,2,6-7,9H2,1H3

Composition: C (61.90%), H (6.39%), O (31.71%)

Molar Mass: 252.266

Atom Count: 34

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 252.099773615
Formal Charge 0
FSP3 0.46
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey WHUHWYZQAUTDRM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.15
Topological Polar Surface Area 53.99
Polarizability 25.34
Ring Count 2
Rotatable Bond Count 6

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Angene International Limited
Purity LeadTime RefID PacketSize UnitPrice
95% <7 Days AG0038EF $104.54-$427.46$104.54$205.97$427.46
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AA BLOCKS INC
Purity LeadTime RefID PacketSize UnitPrice
95% <6 Days AA0038BN $167.90-$587.65$167.90$300.15$587.65
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