3-bromo-3-ethyl-2-methylpentane;λ2-stannane

C8H19BrSn — CID 173457060

IUPAC3-bromo-3-ethyl-2-methylpentane;λ2-stannane
SMILESCCC(Br)(CC)C(C)C.[SnH2]
InChIInChI=1S/C8H17Br.Sn.2H/c1-5-8(9,6-2)7(3)4;;;/h7H,5-6H2,1-4H3;;;
InChIKeyKDTHWEUMJNVVBG-UHFFFAOYSA-N
MW313.86 g/mol
LogP2.68
Rot. Bonds3

About 3-bromo-3-ethyl-2-methylpentane;λ2-stannane

3-bromo-3-ethyl-2-methylpentane;λ2-stannane (PubChem CID 173457060) has the molecular formula C8H19BrSn and a molecular weight of 313.86 g/mol. Its IUPAC name is 3-bromo-3-ethyl-2-methylpentane;λ2-stannane.

Molecular Properties

Compound Name3-bromo-3-ethyl-2-methylpentane;λ2-stannane
PubChem CID173457060
Molecular FormulaC8H19BrSn
Molecular Weight313.86 g/mol
Exact Mass313.97
IUPAC Name3-bromo-3-ethyl-2-methylpentane;λ2-stannane
SMILESCCC(Br)(CC)C(C)C.[SnH2]
InChIInChI=1S/C8H17Br.Sn.2H/c1-5-8(9,6-2)7(3)4;;;/h7H,5-6H2,1-4H3;;;
InChIKeyKDTHWEUMJNVVBG-UHFFFAOYSA-N
XLogP2.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.86
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,3-dibromo-3-(bromomethyl)pentane
CID 134934066
3-bromo-2,3-dimethylpentane
CID 54167618
1,1-dibromopropan-1-amine
CID 130016828
4,4-diethyl-5-methylhex-1-ene
CID 23384984
2,3-dibromo-3-methylpentane
CID 54096666
3,3-diethyl-2-methylpentane;ethane
CID 163394660
2,2-dibromo-3-methylbutane
CID 13047634
bromo-(3-ethyl-2-methylpentan-3-yl)tin
CID 88827902
3-ethyl-2,3,4-trimethyloctane
CID 57491124
1,1-difluoro-1-iodo-2-methylpropane;1,1-difluoro-1-iodopentane
CID 175436112
2-methylpentane-3,3-diol
CID 87103548
ethane;hexane;2,3,3-trimethylpentane
CID 143714855

Frequently Asked Questions

What is the IUPAC name of 3-bromo-3-ethyl-2-methylpentane;λ2-stannane?
The IUPAC name of 3-bromo-3-ethyl-2-methylpentane;λ2-stannane (CID 173457060) is 3-bromo-3-ethyl-2-methylpentane;λ2-stannane.
What is the SMILES notation for 3-bromo-3-ethyl-2-methylpentane;λ2-stannane?
The canonical SMILES for 3-bromo-3-ethyl-2-methylpentane;λ2-stannane is CCC(Br)(CC)C(C)C.[SnH2].
What is the InChIKey of 3-bromo-3-ethyl-2-methylpentane;λ2-stannane?
The InChIKey is KDTHWEUMJNVVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17Br.Sn.2H/c1-5-8(9,6-2)7(3)4;;;/h7H,5-6H2,1-4H3;;;.
What are the key properties of 3-bromo-3-ethyl-2-methylpentane;λ2-stannane?
3-bromo-3-ethyl-2-methylpentane;λ2-stannane has a molecular weight of 313.86 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-3-ethyl-2-methylpentane;λ2-stannane is sourced from PubChem (CID 173457060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).