3-tributylstannylbut-3-en-1-ol

C16H34OSn — CID 14272948

IUPAC3-tributylstannylbut-3-en-1-ol
SMILESC=C(CCO)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C4H7O.3C4H9.Sn/c1-2-3-4-5;3*1-3-4-2;/h5H,1,3-4H2;3*1,3-4H2,2H3;
InChIKeyUAXAHSXCWADQQE-UHFFFAOYSA-N
MW361.16 g/mol
LogP5.31
Rot. Bonds12

About 3-tributylstannylbut-3-en-1-ol

3-tributylstannylbut-3-en-1-ol (PubChem CID 14272948) has the molecular formula C16H34OSn and a molecular weight of 361.16 g/mol. Its IUPAC name is 3-tributylstannylbut-3-en-1-ol.

Molecular Properties

Compound Name3-tributylstannylbut-3-en-1-ol
PubChem CID14272948
Molecular FormulaC16H34OSn
Molecular Weight361.16 g/mol
Exact Mass362.16
IUPAC Name3-tributylstannylbut-3-en-1-ol
SMILESC=C(CCO)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C4H7O.3C4H9.Sn/c1-2-3-4-5;3*1-3-4-2;/h5H,1,3-4H2;3*1,3-4H2,2H3;
InChIKeyUAXAHSXCWADQQE-UHFFFAOYSA-N
XLogP5.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.16
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-tributylstannylbut-3-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-tributylstannylhex-5-en-1-ol
CID 11773674
tributyl(dec-1-en-2-yl)stannane
CID 14784453
5-tributylstannylhex-5-enenitrile
CID 11292042
3-tributylstannylpent-3-en-1-ol
CID 86034571
2-methyl-4-tributylstannylpent-4-en-2-ol
CID 15155654
3-tributylstannylhexa-3,4-dien-1-ol
CID 15122114
(Z)-2,3-bis(tributylstannyl)but-2-ene-1,4-diol
CID 11082898
tributyl(3-piperidin-1-ylprop-1-en-2-yl)stannane
CID 11080173
tributyl(2-tributylstannylhept-1-en-3-yl)stannane
CID 135007451
dibutyl-dodec-1-en-2-yl-iodostannane
CID 11272490
(E)-3-tributylstannylhex-2-en-1-ol
CID 10362882
N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine
CID 10456842

Frequently Asked Questions

What is the IUPAC name of 3-tributylstannylbut-3-en-1-ol?
The IUPAC name of 3-tributylstannylbut-3-en-1-ol (CID 14272948) is 3-tributylstannylbut-3-en-1-ol.
What is the SMILES notation for 3-tributylstannylbut-3-en-1-ol?
The canonical SMILES for 3-tributylstannylbut-3-en-1-ol is C=C(CCO)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of 3-tributylstannylbut-3-en-1-ol?
The InChIKey is UAXAHSXCWADQQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7O.3C4H9.Sn/c1-2-3-4-5;3*1-3-4-2;/h5H,1,3-4H2;3*1,3-4H2,2H3;.
What are the key properties of 3-tributylstannylbut-3-en-1-ol?
3-tributylstannylbut-3-en-1-ol has a molecular weight of 361.16 g/mol, XLogP of 5.31, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tributylstannylbut-3-en-1-ol is sourced from PubChem (CID 14272948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).