[(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury

C19H31Hg — CID 145462727

IUPAC[(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury
SMILESC=C([Hg])CCCCCCC/C=C\C=C\C=C/CCCC
InChIInChI=1S/C19H31.Hg/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2;/h10,12,14,16,18-19H,1,4-9,11,13,15,17H2,2H3;/b12-10-,16-14+,19-18-;
InChIKeyVWWQZWDRJPDKBI-DPILOBPJSA-N
MW460.05 g/mol
LogP6.64
Rot. Bonds13

About [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury

[(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury (PubChem CID 145462727) has the molecular formula C19H31Hg and a molecular weight of 460.05 g/mol. Its IUPAC name is [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury.

Molecular Properties

Compound Name[(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury
PubChem CID145462727
Molecular FormulaC19H31Hg
Molecular Weight460.05 g/mol
Exact Mass461.21
IUPAC Name[(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury
SMILESC=C([Hg])CCCCCCC/C=C\C=C\C=C/CCCC
InChIInChI=1S/C19H31.Hg/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2;/h10,12,14,16,18-19H,1,4-9,11,13,15,17H2,2H3;/b12-10-,16-14+,19-18-;
InChIKeyVWWQZWDRJPDKBI-DPILOBPJSA-N
XLogP6.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.05
LogP ≤ 56.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(5E,7Z)-13-methylideneheptadeca-5,7-diene
CID 57162564
methyl (9E,11E,13E)-octadeca-9,11,13-trienoate
CID 6433658
2-methylprop-2-enoic acid;octadeca-9,11,13-trienoic acid
CID 174415565
(5E,7E)-hexadeca-5,7-diene
CID 13032294
(5Z,7Z)-pentadeca-5,7-diene
CID 14270938
(9Z,11E,13Z)-octadeca-9,11,13-trienoate
CID 25244650
(6E,8E,10E)-pentadeca-6,8,10-trienoic acid
CID 101132736
methyl hexadeca-9,11-dienoate
CID 71381501
methyl (9E,11E)-hexadeca-9,11-dienoate
CID 175988172
(22E)-heptatetraconta-22,24-diene
CID 56629131
(9E,11Z,13E)-nonadeca-9,11,13-trien-2-one
CID 90307096
(17E,19E,21E,23E,27E,31E,33E,35E,37E)-dotetraconta-17,19,21,23,27,31,33,35,37-nonaene-4,9-dione
CID 146373935

Frequently Asked Questions

What is the IUPAC name of [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury?
The IUPAC name of [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury (CID 145462727) is [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury.
What is the SMILES notation for [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury?
The canonical SMILES for [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury is C=C([Hg])CCCCCCC/C=C\C=C\C=C/CCCC.
What is the InChIKey of [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury?
The InChIKey is VWWQZWDRJPDKBI-DPILOBPJSA-N. The full InChI is InChI=1S/C19H31.Hg/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2;/h10,12,14,16,18-19H,1,4-9,11,13,15,17H2,2H3;/b12-10-,16-14+,19-18-;.
What are the key properties of [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury?
[(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury has a molecular weight of 460.05 g/mol, XLogP of 6.64, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(10Z,12E,14Z)-nonadeca-1,10,12,14-tetraen-2-yl]mercury is sourced from PubChem (CID 145462727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).