bromo-(3-ethyl-2-methylpentan-3-yl)tin

C8H17BrSn — CID 88827902

IUPACbromo-(3-ethyl-2-methylpentan-3-yl)tin
SMILESCCC(CC)([Sn]Br)C(C)C
InChIInChI=1S/C8H17.BrH.Sn/c1-5-8(6-2)7(3)4;;/h7H,5-6H2,1-4H3;1H;/q;;+1/p-1
InChIKeyFMYHJMJCDUAVDT-UHFFFAOYSA-M
MW311.84 g/mol
LogP3.64
Rot. Bonds4

About bromo-(3-ethyl-2-methylpentan-3-yl)tin

bromo-(3-ethyl-2-methylpentan-3-yl)tin (PubChem CID 88827902) has the molecular formula C8H17BrSn and a molecular weight of 311.84 g/mol. Its IUPAC name is bromo-(3-ethyl-2-methylpentan-3-yl)tin.

Molecular Properties

Compound Namebromo-(3-ethyl-2-methylpentan-3-yl)tin
PubChem CID88827902
Molecular FormulaC8H17BrSn
Molecular Weight311.84 g/mol
Exact Mass311.95
IUPAC Namebromo-(3-ethyl-2-methylpentan-3-yl)tin
SMILESCCC(CC)([Sn]Br)C(C)C
InChIInChI=1S/C8H17.BrH.Sn/c1-5-8(6-2)7(3)4;;/h7H,5-6H2,1-4H3;1H;/q;;+1/p-1
InChIKeyFMYHJMJCDUAVDT-UHFFFAOYSA-M
XLogP3.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.84
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of bromo-(3-ethyl-2-methylpentan-3-yl)tin?
The IUPAC name of bromo-(3-ethyl-2-methylpentan-3-yl)tin (CID 88827902) is bromo-(3-ethyl-2-methylpentan-3-yl)tin.
What is the SMILES notation for bromo-(3-ethyl-2-methylpentan-3-yl)tin?
The canonical SMILES for bromo-(3-ethyl-2-methylpentan-3-yl)tin is CCC(CC)([Sn]Br)C(C)C.
What is the InChIKey of bromo-(3-ethyl-2-methylpentan-3-yl)tin?
The InChIKey is FMYHJMJCDUAVDT-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H17.BrH.Sn/c1-5-8(6-2)7(3)4;;/h7H,5-6H2,1-4H3;1H;/q;;+1/p-1.
What are the key properties of bromo-(3-ethyl-2-methylpentan-3-yl)tin?
bromo-(3-ethyl-2-methylpentan-3-yl)tin has a molecular weight of 311.84 g/mol, XLogP of 3.64, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo-(3-ethyl-2-methylpentan-3-yl)tin is sourced from PubChem (CID 88827902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).