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2-[8-ethyl-7-fluoro-3-(methoxymethoxy)naphthalen-1-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-[8-ethyl-7-fluoro-3-(methoxymethoxy)naphthalen-1-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 2621932-48-5

Formula: C20H26BFO4

SMILES: CCC1=C2C(=CC=C1F)C=C(OCOC)C=C2B1OC(C)(C)C(C)(C)O1

IUPAC: 2-[8-ethyl-7-fluoro-3-(methoxymethoxy)naphthalen-1-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C20H26BFO4/c1-7-15-17(22)9-8-13-10-14(24-12-23-6)11-16(18(13)15)21-25-19(2,3)20(4,5)26-21/h8-11H,7,12H2,1-6H3

Composition: C (66.68%), H (7.28%), B (3.00%), F (5.27%), O (17.77%)

Molar Mass: 360.23

Atom Count: 52

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 360.190817
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey GGFLAUXTEQHVKF-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 94.34
Topological Polar Surface Area 36.92
Polarizability 39.81
Ring Count 3
Rotatable Bond Count 5

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