bis(4-ethenylhepta-1,6-dien-4-yl)tin

C18H26Sn — CID 173002899

IUPACbis(4-ethenylhepta-1,6-dien-4-yl)tin
SMILESC=CCC(C=C)(CC=C)[Sn]C(C=C)(CC=C)CC=C
InChIInChI=1S/2C9H13.Sn/c2*1-4-7-9(6-3)8-5-2;/h2*4-6H,1-3,7-8H2;
InChIKeyHYKVXORZBMMKGS-UHFFFAOYSA-N
MW361.12 g/mol
LogP5.68
Rot. Bonds12

About bis(4-ethenylhepta-1,6-dien-4-yl)tin

bis(4-ethenylhepta-1,6-dien-4-yl)tin (PubChem CID 173002899) has the molecular formula C18H26Sn and a molecular weight of 361.12 g/mol. Its IUPAC name is bis(4-ethenylhepta-1,6-dien-4-yl)tin.

Molecular Properties

Compound Namebis(4-ethenylhepta-1,6-dien-4-yl)tin
PubChem CID173002899
Molecular FormulaC18H26Sn
Molecular Weight361.12 g/mol
Exact Mass362.11
IUPAC Namebis(4-ethenylhepta-1,6-dien-4-yl)tin
SMILESC=CCC(C=C)(CC=C)[Sn]C(C=C)(CC=C)CC=C
InChIInChI=1S/2C9H13.Sn/c2*1-4-7-9(6-3)8-5-2;/h2*4-6H,1-3,7-8H2;
InChIKeyHYKVXORZBMMKGS-UHFFFAOYSA-N
XLogP5.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.12
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3-methylhexa-1,5-dien-3-olate
CID 101095680
3-methylhexa-1,5-diene-3-thiol
CID 123943954
(3S)-3-methylhexa-1,5-dien-3-ol
CID 11564468
2,2-bis(prop-2-enyl)pent-4-ene-1,1,1-triol
CID 155341339
4-chloro-4-methylpent-1-ene
CID 14174361
3,3-difluorohexa-1,5-diene
CID 90930184
(4R,7S)-4,7-dimethyldeca-1,9-diene-4,7-diol
CID 92533073
4-chloro-4-methylpent-1-ene;silane
CID 174547745
lithium 4-methanidyl-4-methylpent-1-ene
CID 134840187
hepta-1,6-diene-4,4-diamine
CID 21275124
4,5,5,5-tetrafluoro-4-methylpent-1-ene
CID 58901177
4,7-dimethyldeca-1,9-diene-4,7-diamine
CID 10774290

Frequently Asked Questions

What is the IUPAC name of bis(4-ethenylhepta-1,6-dien-4-yl)tin?
The IUPAC name of bis(4-ethenylhepta-1,6-dien-4-yl)tin (CID 173002899) is bis(4-ethenylhepta-1,6-dien-4-yl)tin.
What is the SMILES notation for bis(4-ethenylhepta-1,6-dien-4-yl)tin?
The canonical SMILES for bis(4-ethenylhepta-1,6-dien-4-yl)tin is C=CCC(C=C)(CC=C)[Sn]C(C=C)(CC=C)CC=C.
What is the InChIKey of bis(4-ethenylhepta-1,6-dien-4-yl)tin?
The InChIKey is HYKVXORZBMMKGS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H13.Sn/c2*1-4-7-9(6-3)8-5-2;/h2*4-6H,1-3,7-8H2;.
What are the key properties of bis(4-ethenylhepta-1,6-dien-4-yl)tin?
bis(4-ethenylhepta-1,6-dien-4-yl)tin has a molecular weight of 361.12 g/mol, XLogP of 5.68, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-ethenylhepta-1,6-dien-4-yl)tin is sourced from PubChem (CID 173002899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).