(6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane

C17H34OSi — CID 5052939

IUPAC(6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane
SMILESC=C(C)CC(=CC(C)(C)OC)[Si](C)(CCC)CCC
InChIInChI=1S/C17H34OSi/c1-9-11-19(8,12-10-2)16(13-15(3)4)14-17(5,6)18-7/h14H,3,9-13H2,1-2,4-8H3
InChIKeyNPLPDSXZHJYTAR-UHFFFAOYSA-N
MW282.54 g/mol
LogP5.74
Rot. Bonds9

About (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane

(6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane (PubChem CID 5052939) has the molecular formula C17H34OSi and a molecular weight of 282.54 g/mol. Its IUPAC name is (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane.

Molecular Properties

Compound Name(6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane
PubChem CID5052939
Molecular FormulaC17H34OSi
Molecular Weight282.54 g/mol
Exact Mass282.24
IUPAC Name(6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane
SMILESC=C(C)CC(=CC(C)(C)OC)[Si](C)(CCC)CCC
InChIInChI=1S/C17H34OSi/c1-9-11-19(8,12-10-2)16(13-15(3)4)14-17(5,6)18-7/h14H,3,9-13H2,1-2,4-8H3
InChIKeyNPLPDSXZHJYTAR-UHFFFAOYSA-N
XLogP5.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.54
LogP ≤ 55.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

hydroxy-methyl-(2-methylprop-2-enoxy)-propylsilane
CID 173411548
(2-ethenyl-1-methoxy-4-methylpenta-1,4-dienoxy)-trimethylsilane
CID 71324080
propan-2-imine;trimethoxy(propyl)silane
CID 174526925
(2-methylprop-2-enoxy-propyl-trimethylsilyloxysilyl)methanol
CID 88520936
2-methoxy-2,5-dimethyl-N-propylhex-5-en-3-amine
CID 79198392
2,2-dimethylpropane;2-methylbut-1-ene
CID 143831735
trimethyl-[methyl-(2-methylprop-2-enoxy)-propylsilyl]oxysilane
CID 87705691
methoxyethane;N-(2-methylprop-2-enyl)-2-oxoacetamide
CID 166103220
5-methoxy-2,5-dimethyl-N-propylhept-1-en-4-amine
CID 116758190
methyl (2Z)-2-[4-[tert-butyl(dimethyl)silyl]oxybutyl]-6-methylhepta-2,6-dienoate
CID 10831056
(4E)-3-ethyl-4-methoxy-2-methylhexa-2,4-diene
CID 89283557
2-methyl-4-methylidenehept-1-ene
CID 58948030

Frequently Asked Questions

What is the IUPAC name of (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane?
The IUPAC name of (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane (CID 5052939) is (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane.
What is the SMILES notation for (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane?
The canonical SMILES for (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane is C=C(C)CC(=CC(C)(C)OC)[Si](C)(CCC)CCC.
What is the InChIKey of (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane?
The InChIKey is NPLPDSXZHJYTAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34OSi/c1-9-11-19(8,12-10-2)16(13-15(3)4)14-17(5,6)18-7/h14H,3,9-13H2,1-2,4-8H3.
What are the key properties of (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane?
(6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane has a molecular weight of 282.54 g/mol, XLogP of 5.74, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-2,6-dimethylhepta-1,4-dien-4-yl)-methyl-dipropylsilane is sourced from PubChem (CID 5052939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).