trichloro-[(2R)-undec-3-yn-2-yl]stannane

C11H19Cl3Sn — CID 10339475

IUPACtrichloro-[(2R)-undec-3-yn-2-yl]stannane
SMILESCCCCCCCC#C[C@@H](C)[Sn](Cl)(Cl)Cl
InChIInChI=1S/C11H19.3ClH.Sn/c1-3-5-7-9-11-10-8-6-4-2;;;;/h3H,4,6,8-11H2,1-2H3;3*1H;/q;;;;+3/p-3
InChIKeyZXWRNDWDLCXRII-UHFFFAOYSA-K
MW376.34 g/mol
LogP5.40
Rot. Bonds6

About trichloro-[(2R)-undec-3-yn-2-yl]stannane

trichloro-[(2R)-undec-3-yn-2-yl]stannane (PubChem CID 10339475) has the molecular formula C11H19Cl3Sn and a molecular weight of 376.34 g/mol. Its IUPAC name is trichloro-[(2R)-undec-3-yn-2-yl]stannane.

Molecular Properties

Compound Nametrichloro-[(2R)-undec-3-yn-2-yl]stannane
PubChem CID10339475
Molecular FormulaC11H19Cl3Sn
Molecular Weight376.34 g/mol
Exact Mass375.96
IUPAC Nametrichloro-[(2R)-undec-3-yn-2-yl]stannane
SMILESCCCCCCCC#C[C@@H](C)[Sn](Cl)(Cl)Cl
InChIInChI=1S/C11H19.3ClH.Sn/c1-3-5-7-9-11-10-8-6-4-2;;;;/h3H,4,6,8-11H2,1-2H3;3*1H;/q;;;;+3/p-3
InChIKeyZXWRNDWDLCXRII-UHFFFAOYSA-K
XLogP5.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.34
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trichloro-[(2R)-undec-3-yn-2-yl]stannane?
The IUPAC name of trichloro-[(2R)-undec-3-yn-2-yl]stannane (CID 10339475) is trichloro-[(2R)-undec-3-yn-2-yl]stannane.
What is the SMILES notation for trichloro-[(2R)-undec-3-yn-2-yl]stannane?
The canonical SMILES for trichloro-[(2R)-undec-3-yn-2-yl]stannane is CCCCCCCC#C[C@@H](C)[Sn](Cl)(Cl)Cl.
What is the InChIKey of trichloro-[(2R)-undec-3-yn-2-yl]stannane?
The InChIKey is ZXWRNDWDLCXRII-UHFFFAOYSA-K. The full InChI is InChI=1S/C11H19.3ClH.Sn/c1-3-5-7-9-11-10-8-6-4-2;;;;/h3H,4,6,8-11H2,1-2H3;3*1H;/q;;;;+3/p-3.
What are the key properties of trichloro-[(2R)-undec-3-yn-2-yl]stannane?
trichloro-[(2R)-undec-3-yn-2-yl]stannane has a molecular weight of 376.34 g/mol, XLogP of 5.40, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-[(2R)-undec-3-yn-2-yl]stannane is sourced from PubChem (CID 10339475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).