5-tributylstannylhex-5-en-1-ol

C18H38OSn — CID 11773674

IUPAC5-tributylstannylhex-5-en-1-ol
SMILESC=C(CCCCO)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C6H11O.3C4H9.Sn/c1-2-3-4-5-6-7;3*1-3-4-2;/h7H,1,3-6H2;3*1,3-4H2,2H3;
InChIKeyUUGZOAWMDSCURA-UHFFFAOYSA-N
MW389.21 g/mol
LogP6.09
Rot. Bonds14

About 5-tributylstannylhex-5-en-1-ol

5-tributylstannylhex-5-en-1-ol (PubChem CID 11773674) has the molecular formula C18H38OSn and a molecular weight of 389.21 g/mol. Its IUPAC name is 5-tributylstannylhex-5-en-1-ol.

Molecular Properties

Compound Name5-tributylstannylhex-5-en-1-ol
PubChem CID11773674
Molecular FormulaC18H38OSn
Molecular Weight389.21 g/mol
Exact Mass390.19
IUPAC Name5-tributylstannylhex-5-en-1-ol
SMILESC=C(CCCCO)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C6H11O.3C4H9.Sn/c1-2-3-4-5-6-7;3*1-3-4-2;/h7H,1,3-6H2;3*1,3-4H2,2H3;
InChIKeyUUGZOAWMDSCURA-UHFFFAOYSA-N
XLogP6.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.21
LogP ≤ 56.09
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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Frequently Asked Questions

What is the IUPAC name of 5-tributylstannylhex-5-en-1-ol?
The IUPAC name of 5-tributylstannylhex-5-en-1-ol (CID 11773674) is 5-tributylstannylhex-5-en-1-ol.
What is the SMILES notation for 5-tributylstannylhex-5-en-1-ol?
The canonical SMILES for 5-tributylstannylhex-5-en-1-ol is C=C(CCCCO)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of 5-tributylstannylhex-5-en-1-ol?
The InChIKey is UUGZOAWMDSCURA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11O.3C4H9.Sn/c1-2-3-4-5-6-7;3*1-3-4-2;/h7H,1,3-6H2;3*1,3-4H2,2H3;.
What are the key properties of 5-tributylstannylhex-5-en-1-ol?
5-tributylstannylhex-5-en-1-ol has a molecular weight of 389.21 g/mol, XLogP of 6.09, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tributylstannylhex-5-en-1-ol is sourced from PubChem (CID 11773674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).