[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane

C12H27BSn — CID 5362824

IUPAC[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane
SMILESCCB(CC)/C(CC)=C(\C)[Sn](C)(C)C
InChIInChI=1S/C9H18B.3CH3.Sn/c1-5-9(6-2)10(7-3)8-4;;;;/h5,7-8H2,1-4H3;3*1H3;
InChIKeyPIHIMIQGVTTXOI-UHFFFAOYSA-N
MW300.87 g/mol
LogP4.66
Rot. Bonds5

About [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane

[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane (PubChem CID 5362824) has the molecular formula C12H27BSn and a molecular weight of 300.87 g/mol. Its IUPAC name is [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane.

Molecular Properties

Compound Name[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane
PubChem CID5362824
Molecular FormulaC12H27BSn
Molecular Weight300.87 g/mol
Exact Mass302.12
IUPAC Name[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane
SMILESCCB(CC)/C(CC)=C(\C)[Sn](C)(C)C
InChIInChI=1S/C9H18B.3CH3.Sn/c1-5-9(6-2)10(7-3)8-4;;;;/h5,7-8H2,1-4H3;3*1H3;
InChIKeyPIHIMIQGVTTXOI-UHFFFAOYSA-N
XLogP4.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.87
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(E)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane
CID 12060888
[(E)-3-diethylboranylpent-2-en-2-yl]-trimethylgermane
CID 14436720
Borane, ((1Z)-1-ethyl-2-methyl-1,2-ethenediyl)bis(diethyl-
CID 15733565
1H-1,3-Diborole, 1,3,4,5-tetraethyl-2,3-dihydro-2-methyl-
CID 534721
[(E)-3-diethylboranylpent-2-en-2-yl]-trimethylplumbane
CID 14387253
[(E)-3-diethylboranyloct-3-en-4-yl]-trimethylstannane
CID 14917780
[(Z)-4-diethylboranylhex-3-en-3-yl]-diethylborane
CID 15733569
[(E)-3-diethylboranylpent-2-en-2-yl]-triethylplumbane
CID 134903661
Diethyl-(4-ethyl-1,1-dimethyl-2,5-dihydrostannol-3-yl)borane
CID 135048460
[(E)-4-fluorohex-3-en-3-yl]-trimethylboranuide
CID 177852632
3-Diethylboranylpent-2-en-2-yl(trimethyl)stannane
CID 534929
Borane, diethyl(1-ethyl-2-methyl-1-butenyl)-, (Z)-
CID 5362753

Frequently Asked Questions

What is the IUPAC name of [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane?
The IUPAC name of [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane (CID 5362824) is [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane.
What is the SMILES notation for [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane?
The canonical SMILES for [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane is CCB(CC)/C(CC)=C(\C)[Sn](C)(C)C.
What is the InChIKey of [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane?
The InChIKey is PIHIMIQGVTTXOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18B.3CH3.Sn/c1-5-9(6-2)10(7-3)8-4;;;;/h5,7-8H2,1-4H3;3*1H3;.
What are the key properties of [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane?
[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane has a molecular weight of 300.87 g/mol, XLogP of 4.66, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylstannane is sourced from PubChem (CID 5362824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).