trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane

C11H22Sn — CID 11425779

IUPACtrimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane
SMILESCC/C=C(C)/C=C(/C)[Sn](C)(C)C
InChIInChI=1S/C8H13.3CH3.Sn/c1-4-6-8(3)7-5-2;;;;/h6-7H,4H2,1-3H3;3*1H3;/b7-5?,8-6+;;;;
InChIKeyLXHBOCBFDTYFPH-RQOCZZRHSA-N
MW273.01 g/mol
LogP4.17
Rot. Bonds3

About trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane

trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane (PubChem CID 11425779) has the molecular formula C11H22Sn and a molecular weight of 273.01 g/mol. Its IUPAC name is trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane.

Molecular Properties

Compound Nametrimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane
PubChem CID11425779
Molecular FormulaC11H22Sn
Molecular Weight273.01 g/mol
Exact Mass274.07
IUPAC Nametrimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane
SMILESCC/C=C(C)/C=C(/C)[Sn](C)(C)C
InChIInChI=1S/C8H13.3CH3.Sn/c1-4-6-8(3)7-5-2;;;;/h6-7H,4H2,1-3H3;3*1H3;/b7-5?,8-6+;;;;
InChIKeyLXHBOCBFDTYFPH-RQOCZZRHSA-N
XLogP4.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.01
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

trans-Alloocimene
CID 5368821
Farnesene
CID 5281516
beta-Ocimene
CID 18756
beta-Ocimene, (3Z)-
CID 5320250
2,4,4-Trimethyl-2-pentene
CID 7869
beta-OCIMENE, (3E)-
CID 5281553
2,6-Dimethylocta-2,4,6-triene
CID 12658
2,4-Hexadiene, 3-methyl-
CID 5367612
(Z,E)-alpha-Farnesene
CID 5362889
(3E)-4,8-dimethyl-1,3,7-nonatriene
CID 6427110
1,3-Pentadiene, 2-methyl-
CID 14238
alpha-Ocimene
CID 5320249

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane?
The IUPAC name of trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane (CID 11425779) is trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane.
What is the SMILES notation for trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane?
The canonical SMILES for trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane is CC/C=C(C)/C=C(/C)[Sn](C)(C)C.
What is the InChIKey of trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane?
The InChIKey is LXHBOCBFDTYFPH-RQOCZZRHSA-N. The full InChI is InChI=1S/C8H13.3CH3.Sn/c1-4-6-8(3)7-5-2;;;;/h6-7H,4H2,1-3H3;3*1H3;/b7-5?,8-6+;;;;.
What are the key properties of trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane?
trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane has a molecular weight of 273.01 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2Z,4E)-4-methylhepta-2,4-dien-2-yl]stannane is sourced from PubChem (CID 11425779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).