(E,2R)-4-tributylstannylbut-3-en-2-ol

C16H34OSn — CID 11279891

IUPAC(E,2R)-4-tributylstannylbut-3-en-2-ol
SMILESCCCC[Sn](/C=C/[C@@H](C)O)(CCCC)CCCC
InChIInChI=1S/C4H7O.3C4H9.Sn/c1-3-4(2)5;3*1-3-4-2;/h1,3-5H,2H3;3*1,3-4H2,2H3;/t4-;;;;/m1..../s1
InChIKeyJDGHITRWXNGSKV-KWRROICRSA-N
MW361.16 g/mol
LogP5.31
Rot. Bonds11

About (E,2R)-4-tributylstannylbut-3-en-2-ol

(E,2R)-4-tributylstannylbut-3-en-2-ol (PubChem CID 11279891) has the molecular formula C16H34OSn and a molecular weight of 361.16 g/mol. Its IUPAC name is (E,2R)-4-tributylstannylbut-3-en-2-ol.

Molecular Properties

Compound Name(E,2R)-4-tributylstannylbut-3-en-2-ol
PubChem CID11279891
Molecular FormulaC16H34OSn
Molecular Weight361.16 g/mol
Exact Mass362.16
IUPAC Name(E,2R)-4-tributylstannylbut-3-en-2-ol
SMILESCCCC[Sn](/C=C/[C@@H](C)O)(CCCC)CCCC
InChIInChI=1S/C4H7O.3C4H9.Sn/c1-3-4(2)5;3*1-3-4-2;/h1,3-5H,2H3;3*1,3-4H2,2H3;/t4-;;;;/m1..../s1
InChIKeyJDGHITRWXNGSKV-KWRROICRSA-N
XLogP5.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

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

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Frequently Asked Questions

What is the IUPAC name of (E,2R)-4-tributylstannylbut-3-en-2-ol?
The IUPAC name of (E,2R)-4-tributylstannylbut-3-en-2-ol (CID 11279891) is (E,2R)-4-tributylstannylbut-3-en-2-ol.
What is the SMILES notation for (E,2R)-4-tributylstannylbut-3-en-2-ol?
The canonical SMILES for (E,2R)-4-tributylstannylbut-3-en-2-ol is CCCC[Sn](/C=C/[C@@H](C)O)(CCCC)CCCC.
What is the InChIKey of (E,2R)-4-tributylstannylbut-3-en-2-ol?
The InChIKey is JDGHITRWXNGSKV-KWRROICRSA-N. The full InChI is InChI=1S/C4H7O.3C4H9.Sn/c1-3-4(2)5;3*1-3-4-2;/h1,3-5H,2H3;3*1,3-4H2,2H3;/t4-;;;;/m1..../s1.
What are the key properties of (E,2R)-4-tributylstannylbut-3-en-2-ol?
(E,2R)-4-tributylstannylbut-3-en-2-ol has a molecular weight of 361.16 g/mol, XLogP of 5.31, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,2R)-4-tributylstannylbut-3-en-2-ol is sourced from PubChem (CID 11279891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).