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

C12H27BSi — CID 12871273

IUPAC[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane
SMILESCCB(CC)/C(CC)=C(\C)[Si](C)(C)C
InChIInChI=1S/C12H27BSi/c1-8-12(13(9-2)10-3)11(4)14(5,6)7/h8-10H2,1-7H3/b12-11+
InChIKeyDLOUTEQULBXMJH-VAWYXSNFSA-N
MW210.25 g/mol
LogP4.66
Rot. Bonds5

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

[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane (PubChem CID 12871273) has the molecular formula C12H27BSi and a molecular weight of 210.25 g/mol. Its IUPAC name is [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane
PubChem CID12871273
Molecular FormulaC12H27BSi
Molecular Weight210.25 g/mol
Exact Mass210.20
IUPAC Name[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane
SMILESCCB(CC)/C(CC)=C(\C)[Si](C)(C)C
InChIInChI=1S/C12H27BSi/c1-8-12(13(9-2)10-3)11(4)14(5,6)7/h8-10H2,1-7H3/b12-11+
InChIKeyDLOUTEQULBXMJH-VAWYXSNFSA-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 ≤ 500210.25
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

1-Oxa-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
CID 574206
2-Pentene, 3-diethylboryl-2-trimethylsilyl-
CID 5366484
3-Hexene, 3-diethylboryl-4-trimethylsilyl-
CID 5366485
[(E)-3-diethylboranylpent-2-en-2-yl]-ethyl-dimethylsilane
CID 14436714
e-1-Diallylboranyl-1-allyl-2-methyl-2-trimethylsilylethene
CID 15889222
(e)-Diethylboryl-2-trimethylsilyl-pent-2-ene
CID 129828524
(e)-Diethylboryl-2-dimethyl-silyl-pent-2-ene
CID 129828783
CID 134870873
CID 134870873
CID 134892675
CID 134892675
1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
CID 593224
1-Oxa-2-sila-5-boracyclopent-3-ene, 2,4,5-triethyl-2,3-dimethyl-
CID 597424
1-Selena-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
CID 608947

Frequently Asked Questions

What is the IUPAC name of [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane?
The IUPAC name of [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane (CID 12871273) is [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane.
What is the SMILES notation for [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane?
The canonical SMILES for [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane is CCB(CC)/C(CC)=C(\C)[Si](C)(C)C.
What is the InChIKey of [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane?
The InChIKey is DLOUTEQULBXMJH-VAWYXSNFSA-N. The full InChI is InChI=1S/C12H27BSi/c1-8-12(13(9-2)10-3)11(4)14(5,6)7/h8-10H2,1-7H3/b12-11+.
What are the key properties of [(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane?
[(Z)-3-diethylboranylpent-2-en-2-yl]-trimethylsilane has a molecular weight of 210.25 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]-trimethylsilane is sourced from PubChem (CID 12871273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).