bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane

C146H110Ga4N8O12 — CID 157401984

IUPACbis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane
SMILESCc1ccc2cccc(O[Ga](Oc3c(-c4ccccc4)cc4ccccc4c3-c3ccccc3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3c(-c4ccccc4)cccc3-c3ccccc3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3ccc4cc(-c5ccccc5)ccc4c3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3cccc4ccccc34)Oc3cccc4ccc(C)nc34)c2n1
InChIInChI=1S/C22H16O.C18H14O.C16H12O.8C10H9NO.C10H8O.4Ga/c23-22-20(16-9-3-1-4-10-16)15-18-13-7-8-14-19(18)21(22)17-11-5-2-6-12-17;19-18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15;17-16-9-8-14-10-13(6-7-15(14)11-16)12-4-2-1-3-5-12;8*1-7-5-6-8-3-2-4-9(12)10(8)11-7;11-10-7-3-5-8-4-1-2-6-9(8)10;;;;/h1-15,23H;1-13,19H;1-11,17H;8*2-6,12H,1H3;1-7,11H;;;;/q;;;;;;;;;;;;4*+3/p-12
InChIKeyBNGXKJCBPFZLBU-UHFFFAOYSA-B
MW2447.42 g/mol
LogP35.48
Rot. Bonds29

About bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane

bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane (PubChem CID 157401984) has the molecular formula C146H110Ga4N8O12 and a molecular weight of 2447.42 g/mol. Its IUPAC name is bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane.

Molecular Properties

Compound Namebis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane
PubChem CID157401984
Molecular FormulaC146H110Ga4N8O12
Molecular Weight2447.42 g/mol
Exact Mass2442.53
IUPAC Namebis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane
SMILESCc1ccc2cccc(O[Ga](Oc3c(-c4ccccc4)cc4ccccc4c3-c3ccccc3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3c(-c4ccccc4)cccc3-c3ccccc3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3ccc4cc(-c5ccccc5)ccc4c3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3cccc4ccccc34)Oc3cccc4ccc(C)nc34)c2n1
InChIInChI=1S/C22H16O.C18H14O.C16H12O.8C10H9NO.C10H8O.4Ga/c23-22-20(16-9-3-1-4-10-16)15-18-13-7-8-14-19(18)21(22)17-11-5-2-6-12-17;19-18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15;17-16-9-8-14-10-13(6-7-15(14)11-16)12-4-2-1-3-5-12;8*1-7-5-6-8-3-2-4-9(12)10(8)11-7;11-10-7-3-5-8-4-1-2-6-9(8)10;;;;/h1-15,23H;1-13,19H;1-11,17H;8*2-6,12H,1H3;1-7,11H;;;;/q;;;;;;;;;;;;4*+3/p-12
InChIKeyBNGXKJCBPFZLBU-UHFFFAOYSA-B
XLogP35.48
TPSA213.88 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds29
Heavy Atoms170
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002447.42
LogP ≤ 535.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane?
The IUPAC name of bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane (CID 157401984) is bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane.
What is the SMILES notation for bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane?
The canonical SMILES for bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane is Cc1ccc2cccc(O[Ga](Oc3c(-c4ccccc4)cc4ccccc4c3-c3ccccc3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3c(-c4ccccc4)cccc3-c3ccccc3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3ccc4cc(-c5ccccc5)ccc4c3)Oc3cccc4ccc(C)nc34)c2n1.Cc1ccc2cccc(O[Ga](Oc3cccc4ccccc34)Oc3cccc4ccc(C)nc34)c2n1.
What is the InChIKey of bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane?
The InChIKey is BNGXKJCBPFZLBU-UHFFFAOYSA-B. The full InChI is InChI=1S/C22H16O.C18H14O.C16H12O.8C10H9NO.C10H8O.4Ga/c23-22-20(16-9-3-1-4-10-16)15-18-13-7-8-14-19(18)21(22)17-11-5-2-6-12-17;19-18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15;17-16-9-8-14-10-13(6-7-15(14)11-16)12-4-2-1-3-5-12;8*1-7-5-6-8-3-2-4-9(12)10(8)11-7;11-10-7-3-5-8-4-1-2-6-9(8)10;;;;/h1-15,23H;1-13,19H;1-11,17H;8*2-6,12H,1H3;1-7,11H;;;;/q;;;;;;;;;;;;4*+3/p-12.
What are the key properties of bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane?
bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane has a molecular weight of 2447.42 g/mol, XLogP of 35.48, 29 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for bis[(2-methylquinolin-8-yl)oxy]-naphthalen-1-yloxygallane;bis[(2-methylquinolin-8-yl)oxy]-(6-phenylnaphthalen-2-yl)oxygallane;(1,3-diphenylnaphthalen-2-yl)oxy-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-diphenylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane is sourced from PubChem (CID 157401984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).