[(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane

C19H35BrSi — CID 166637294

IUPAC[(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane
SMILESCC/C=C\CCCC(Br)C#C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H35BrSi/c1-8-9-10-11-12-13-19(20)14-15-21(16(2)3,17(4)5)18(6)7/h9-10,16-19H,8,11-13H2,1-7H3/b10-9-
InChIKeyVKHTXBMICCNSHC-KTKRTIGZSA-N
MW371.48 g/mol
LogP7.11
Rot. Bonds8

About [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane

[(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane (PubChem CID 166637294) has the molecular formula C19H35BrSi and a molecular weight of 371.48 g/mol. Its IUPAC name is [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane
PubChem CID166637294
Molecular FormulaC19H35BrSi
Molecular Weight371.48 g/mol
Exact Mass370.17
IUPAC Name[(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane
SMILESCC/C=C\CCCC(Br)C#C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H35BrSi/c1-8-9-10-11-12-13-19(20)14-15-21(16(2)3,17(4)5)18(6)7/h9-10,16-19H,8,11-13H2,1-7H3/b10-9-
InChIKeyVKHTXBMICCNSHC-KTKRTIGZSA-N
XLogP7.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.48
LogP ≤ 57.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(Z,3S)-3-[2-tri(propan-2-yl)silylethynyl]non-6-enal
CID 44517963
8-methylnon-3-ene
CID 54424784
[3-bromo-6-(5,5-dimethyl-1,3-dioxan-2-yl)hex-1-ynyl]-tri(propan-2-yl)silane
CID 166637290
(E,2S)-non-6-en-2-ol
CID 12835465
(Z)-non-6-en-2-ol
CID 12835464
8-methyldec-3-ene
CID 54115614
(Z)-2-methylnon-6-enenitrile
CID 10773147
dec-7-ene-2,3-diol
CID 142773808
(Z)-non-6-ene-1,1-diol
CID 170555028
(3E,8E,15E,20E)-12-propan-2-yltricosa-3,8,15,20-tetraene
CID 177270175
10-methylundec-3-ene
CID 544769
(3R)-3-propan-2-yl-5-tri(propan-2-yl)silylpent-4-ynal
CID 102296905

Frequently Asked Questions

What is the IUPAC name of [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane?
The IUPAC name of [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane (CID 166637294) is [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane.
What is the SMILES notation for [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane?
The canonical SMILES for [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane is CC/C=C\CCCC(Br)C#C[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane?
The InChIKey is VKHTXBMICCNSHC-KTKRTIGZSA-N. The full InChI is InChI=1S/C19H35BrSi/c1-8-9-10-11-12-13-19(20)14-15-21(16(2)3,17(4)5)18(6)7/h9-10,16-19H,8,11-13H2,1-7H3/b10-9-.
What are the key properties of [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane?
[(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane has a molecular weight of 371.48 g/mol, XLogP of 7.11, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3-bromodec-7-en-1-ynyl]-tri(propan-2-yl)silane is sourced from PubChem (CID 166637294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).