dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline

C28H26Cl2N2Sn — CID 4574299

IUPACdichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline
SMILESCC[Sn](Cl)(Cl)CC.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1
InChIInChI=1S/C24H16N2.2C2H5.2ClH.Sn/c1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;2*1-2;;;/h1-16H;2*1H2,2H3;2*1H;/q;;;;;+2/p-2
InChIKeyHVNYPEBMVNAXJI-UHFFFAOYSA-L
MW580.15 g/mol
LogP9.06
Rot. Bonds4

About dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline

dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline (PubChem CID 4574299) has the molecular formula C28H26Cl2N2Sn and a molecular weight of 580.15 g/mol. Its IUPAC name is dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline.

Molecular Properties

Compound Namedichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline
PubChem CID4574299
Molecular FormulaC28H26Cl2N2Sn
Molecular Weight580.15 g/mol
Exact Mass580.05
IUPAC Namedichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline
SMILESCC[Sn](Cl)(Cl)CC.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1
InChIInChI=1S/C24H16N2.2C2H5.2ClH.Sn/c1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;2*1-2;;;/h1-16H;2*1H2,2H3;2*1H;/q;;;;;+2/p-2
InChIKeyHVNYPEBMVNAXJI-UHFFFAOYSA-L
XLogP9.06
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500580.15
LogP ≤ 59.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

4,7-diphenyl-1,10-phenanthroline;thorium(4+);tetrachloride
CID 21087820
dichlororhodium(1+);bis(4,7-diphenyl-1,10-phenanthroline);chloride
CID 173138363
tris(4,7-diphenyl-1,10-phenanthroline);hydride;ruthenium;dichloride
CID 173290116
4,7-diphenyl-1,10-phenanthroline;ruthenium;dihydrochloride
CID 173105288
4-chloro-7-phenyl-1,10-phenanthroline
CID 171832712
4-bromo-7-phenyl-1,10-phenanthroline
CID 18759599
4,7-diphenyl-2-propyl-1,10-phenanthroline
CID 123268572
copper(1+);4,7-diphenyl-1,10-phenanthroline;bis(triphenylphosphane)
CID 158177227
4-[4-(7-phenyl-1,10-phenanthrolin-4-yl)phenyl]aniline
CID 102574675
4-benzyl-7-phenyl-1,10-phenanthroline
CID 142216618
tris(4,7-diphenyl-1,10-phenanthroline);fluorophosphonic acid
CID 173166760
4-(2-heptan-2-ylphenyl)-7-phenyl-1,10-phenanthroline
CID 123646075

Frequently Asked Questions

What is the IUPAC name of dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline?
The IUPAC name of dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline (CID 4574299) is dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline.
What is the SMILES notation for dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline?
The canonical SMILES for dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline is CC[Sn](Cl)(Cl)CC.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.
What is the InChIKey of dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline?
The InChIKey is HVNYPEBMVNAXJI-UHFFFAOYSA-L. The full InChI is InChI=1S/C24H16N2.2C2H5.2ClH.Sn/c1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;2*1-2;;;/h1-16H;2*1H2,2H3;2*1H;/q;;;;;+2/p-2.
What are the key properties of dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline?
dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline has a molecular weight of 580.15 g/mol, XLogP of 9.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(diethyl)stannane;4,7-diphenyl-1,10-phenanthroline is sourced from PubChem (CID 4574299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).