magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide

C24H30BrCl3MgSn2 — CID 159157756

IUPACmagnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide
SMILESC=CC[Sn](CC=C)(CC=C)c1ccccc1.C=C[CH2-].Cl[Sn](Cl)(Cl)c1ccccc1.[Br-].[Mg+2]
InChIInChI=1S/2C6H5.4C3H5.BrH.3ClH.Mg.2Sn/c2*1-2-4-6-5-3-1;4*1-3-2;;;;;;;/h2*1-5H;4*3H,1-2H2;4*1H;;;/q;;;;;-1;;;;;+2;;+3/p-4
InChIKeyGUCHNXHIEYWBAP-UHFFFAOYSA-J
MW766.49 g/mol
LogP4.08
Rot. Bonds8

About magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide

magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide (PubChem CID 159157756) has the molecular formula C24H30BrCl3MgSn2 and a molecular weight of 766.49 g/mol. Its IUPAC name is magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide.

Molecular Properties

Compound Namemagnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide
PubChem CID159157756
Molecular FormulaC24H30BrCl3MgSn2
Molecular Weight766.49 g/mol
Exact Mass765.85
IUPAC Namemagnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide
SMILESC=CC[Sn](CC=C)(CC=C)c1ccccc1.C=C[CH2-].Cl[Sn](Cl)(Cl)c1ccccc1.[Br-].[Mg+2]
InChIInChI=1S/2C6H5.4C3H5.BrH.3ClH.Mg.2Sn/c2*1-2-4-6-5-3-1;4*1-3-2;;;;;;;/h2*1-5H;4*3H,1-2H2;4*1H;;;/q;;;;;-1;;;;;+2;;+3/p-4
InChIKeyGUCHNXHIEYWBAP-UHFFFAOYSA-J
XLogP4.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500766.49
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

phenyl-tris(prop-2-enyl)stannane
CID 607532
magnesium;styrene;dibromide
CID 170339005
sodium;benzene;prop-1-ene
CID 173088614
dichloro(diphenyl)stannane
CID 14342
dichloro-bis(prop-2-enyl)stannane
CID 23256476
diphenyl(prop-2-enyl)alumane
CID 16702068
(3-phenyl-2-prop-1-enylphenyl)-tris(prop-2-enyl)stannane
CID 67907493
sulfane;bis(tributyl(phenyl)stannane)
CID 67835272
chloromethane;styrene
CID 122701035
CID 70443008
CID 70443008
prop-2-enylbenzene
CID 159998516
magnesium;1-phenylbut-3-enylideneazanide;chloride
CID 10013141

Frequently Asked Questions

What is the IUPAC name of magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide?
The IUPAC name of magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide (CID 159157756) is magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide.
What is the SMILES notation for magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide?
The canonical SMILES for magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide is C=CC[Sn](CC=C)(CC=C)c1ccccc1.C=C[CH2-].Cl[Sn](Cl)(Cl)c1ccccc1.[Br-].[Mg+2].
What is the InChIKey of magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide?
The InChIKey is GUCHNXHIEYWBAP-UHFFFAOYSA-J. The full InChI is InChI=1S/2C6H5.4C3H5.BrH.3ClH.Mg.2Sn/c2*1-2-4-6-5-3-1;4*1-3-2;;;;;;;/h2*1-5H;4*3H,1-2H2;4*1H;;;/q;;;;;-1;;;;;+2;;+3/p-4.
What are the key properties of magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide?
magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide has a molecular weight of 766.49 g/mol, XLogP of 4.08, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;phenyl-tris(prop-2-enyl)stannane;prop-1-ene;trichloro(phenyl)stannane;bromide is sourced from PubChem (CID 159157756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).