hexadecanoic acid;λ2-stannane

C16H34O2Sn — CID 173014096

IUPAChexadecanoic acid;λ2-stannane
SMILESCCCCCCCCCCCCCCCC(=O)O.[SnH2]
InChIInChI=1S/C16H32O2.Sn.2H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;;;/h2-15H2,1H3,(H,17,18);;;
InChIKeyIVONDIAYVQADRU-UHFFFAOYSA-N
MW377.16 g/mol
LogP4.64
Rot. Bonds14

About hexadecanoic acid;λ2-stannane

hexadecanoic acid;λ2-stannane (PubChem CID 173014096) has the molecular formula C16H34O2Sn and a molecular weight of 377.16 g/mol. Its IUPAC name is hexadecanoic acid;λ2-stannane.

Molecular Properties

Compound Namehexadecanoic acid;λ2-stannane
PubChem CID173014096
Molecular FormulaC16H34O2Sn
Molecular Weight377.16 g/mol
Exact Mass378.16
IUPAC Namehexadecanoic acid;λ2-stannane
SMILESCCCCCCCCCCCCCCCC(=O)O.[SnH2]
InChIInChI=1S/C16H32O2.Sn.2H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;;;/h2-15H2,1H3,(H,17,18);;;
InChIKeyIVONDIAYVQADRU-UHFFFAOYSA-N
XLogP4.64
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.16
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

heptanoic acid;λ2-stannane
CID 173301030
henicosane;tetracontanoic acid
CID 175935348
bis(decanoic acid);bis(octanoic acid)
CID 160578094
decanoic acid;bis(nonanoic acid)
CID 159376136
henicosane;tricosanoic acid
CID 175935357
decanoic acid;tetradecanoic acid
CID 87611521
decanoic acid;dodecanoic acid;hexadecanoic acid;octanoic acid;tetradecanoic acid
CID 159524024
decanoic acid;bis(dodecanoic acid)
CID 88765096
bis(hexanedioic acid);bis(tridecane)
CID 173306988
decanedioic acid;nonane
CID 25154161
decanoic acid
CID 158633075
decanoic acid;hexanedioic acid
CID 87189912

Frequently Asked Questions

What is the IUPAC name of hexadecanoic acid;λ2-stannane?
The IUPAC name of hexadecanoic acid;λ2-stannane (CID 173014096) is hexadecanoic acid;λ2-stannane.
What is the SMILES notation for hexadecanoic acid;λ2-stannane?
The canonical SMILES for hexadecanoic acid;λ2-stannane is CCCCCCCCCCCCCCCC(=O)O.[SnH2].
What is the InChIKey of hexadecanoic acid;λ2-stannane?
The InChIKey is IVONDIAYVQADRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2.Sn.2H/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;;;/h2-15H2,1H3,(H,17,18);;;.
What are the key properties of hexadecanoic acid;λ2-stannane?
hexadecanoic acid;λ2-stannane has a molecular weight of 377.16 g/mol, XLogP of 4.64, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hexadecanoic acid;λ2-stannane is sourced from PubChem (CID 173014096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).