2-phenyl-4-trimethylstannylpent-4-en-2-ol

C14H22OSn — CID 14290604

IUPAC2-phenyl-4-trimethylstannylpent-4-en-2-ol
SMILESC=C(CC(C)(O)c1ccccc1)[Sn](C)(C)C
InChIInChI=1S/C11H13O.3CH3.Sn/c1-3-9-11(2,12)10-7-5-4-6-8-10;;;;/h4-8,12H,1,9H2,2H3;3*1H3;
InChIKeyKLEKDLNXSAKUFG-UHFFFAOYSA-N
MW325.04 g/mol
LogP3.72
Rot. Bonds4

About 2-phenyl-4-trimethylstannylpent-4-en-2-ol

2-phenyl-4-trimethylstannylpent-4-en-2-ol (PubChem CID 14290604) has the molecular formula C14H22OSn and a molecular weight of 325.04 g/mol. Its IUPAC name is 2-phenyl-4-trimethylstannylpent-4-en-2-ol.

Molecular Properties

Compound Name2-phenyl-4-trimethylstannylpent-4-en-2-ol
PubChem CID14290604
Molecular FormulaC14H22OSn
Molecular Weight325.04 g/mol
Exact Mass326.07
IUPAC Name2-phenyl-4-trimethylstannylpent-4-en-2-ol
SMILESC=C(CC(C)(O)c1ccccc1)[Sn](C)(C)C
InChIInChI=1S/C11H13O.3CH3.Sn/c1-3-9-11(2,12)10-7-5-4-6-8-10;;;;/h4-8,12H,1,9H2,2H3;3*1H3;
InChIKeyKLEKDLNXSAKUFG-UHFFFAOYSA-N
XLogP3.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.04
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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(E)-4-methyl-5-methylsulfanyl-2-phenylpent-4-en-2-ol
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5-methylidene-3-phenylhept-6-en-3-ol
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1-[5-(2-hydroxy-2-phenylpropyl)-1,3,4-thiadiazol-2-yl]-2-phenylpropan-2-ol
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(2R)-3-methyl-2-phenylbut-3-en-2-ol
CID 102163421
1-amino-2-phenylpropan-2-ol;hydrochloride
CID 17039439
(Z)-3-methyl-5-phenylhex-2-ene-1,5-diol
CID 10856650
5-methyl-3-phenylhex-5-ene-1,3-diol
CID 90346624
3-hydroxy-N-(2-hydroxy-2-phenylpropyl)-3-phenylbutanamide
CID 110025392
4,4,4-trifluoro-2-phenylbutan-2-ol
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CID 46888754

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-trimethylstannylpent-4-en-2-ol?
The IUPAC name of 2-phenyl-4-trimethylstannylpent-4-en-2-ol (CID 14290604) is 2-phenyl-4-trimethylstannylpent-4-en-2-ol.
What is the SMILES notation for 2-phenyl-4-trimethylstannylpent-4-en-2-ol?
The canonical SMILES for 2-phenyl-4-trimethylstannylpent-4-en-2-ol is C=C(CC(C)(O)c1ccccc1)[Sn](C)(C)C.
What is the InChIKey of 2-phenyl-4-trimethylstannylpent-4-en-2-ol?
The InChIKey is KLEKDLNXSAKUFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13O.3CH3.Sn/c1-3-9-11(2,12)10-7-5-4-6-8-10;;;;/h4-8,12H,1,9H2,2H3;3*1H3;.
What are the key properties of 2-phenyl-4-trimethylstannylpent-4-en-2-ol?
2-phenyl-4-trimethylstannylpent-4-en-2-ol has a molecular weight of 325.04 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-trimethylstannylpent-4-en-2-ol is sourced from PubChem (CID 14290604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).