3-methylpentane;zinc

C6H13Zn- — CID 154150944

IUPAC3-methylpentane;zinc
SMILES[CH2-]CC(C)CC.[Zn]
InChIInChI=1S/C6H13.Zn/c1-4-6(3)5-2;/h6H,1,4-5H2,2-3H3;/q-1;
InChIKeyLGNVYAJUAHCYMV-UHFFFAOYSA-N
MW150.56 g/mol
LogP2.25
Rot. Bonds2

About 3-methylpentane;zinc

3-methylpentane;zinc (PubChem CID 154150944) has the molecular formula C6H13Zn- and a molecular weight of 150.56 g/mol. Its IUPAC name is 3-methylpentane;zinc.

Molecular Properties

Compound Name3-methylpentane;zinc
PubChem CID154150944
Molecular FormulaC6H13Zn-
Molecular Weight150.56 g/mol
Exact Mass149.03
IUPAC Name3-methylpentane;zinc
SMILES[CH2-]CC(C)CC.[Zn]
InChIInChI=1S/C6H13.Zn/c1-4-6(3)5-2;/h6H,1,4-5H2,2-3H3;/q-1;
InChIKeyLGNVYAJUAHCYMV-UHFFFAOYSA-N
XLogP2.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.56
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

methane;3-methylpentane
CID 157218592
3-methylpentane;hydrate
CID 144914279
methane;3-methylpentane
CID 153359275
3-methylpentane;propane
CID 123266773
ethane;3-methylpentane
CID 91147782
3,7-dimethyl-5-(2-methylbutyl)nonane;tris(yttrium)
CID 58697885
(4S)-2,4-dimethylhexane
CID 22810193
(4R)-2,4-dimethylhexane;methane
CID 157133469
2,4-dimethylhexane;propane
CID 143348383
curium;3-methylheptane
CID 59030306
2,5-dimethylheptane
CID 90756934
2,4,6,8-tetramethyldecane
CID 54224604

Frequently Asked Questions

What is the IUPAC name of 3-methylpentane;zinc?
The IUPAC name of 3-methylpentane;zinc (CID 154150944) is 3-methylpentane;zinc.
What is the SMILES notation for 3-methylpentane;zinc?
The canonical SMILES for 3-methylpentane;zinc is [CH2-]CC(C)CC.[Zn].
What is the InChIKey of 3-methylpentane;zinc?
The InChIKey is LGNVYAJUAHCYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13.Zn/c1-4-6(3)5-2;/h6H,1,4-5H2,2-3H3;/q-1;.
What are the key properties of 3-methylpentane;zinc?
3-methylpentane;zinc has a molecular weight of 150.56 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylpentane;zinc is sourced from PubChem (CID 154150944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).