5-[methoxy(phenyl)silyl]pentyl prop-2-enoate

C15H22O3Si — CID 175438813

IUPAC5-[methoxy(phenyl)silyl]pentyl prop-2-enoate
SMILESC=CC(=O)OCCCCC[SiH](OC)c1ccccc1
InChIInChI=1S/C15H22O3Si/c1-3-15(16)18-12-8-5-9-13-19(17-2)14-10-6-4-7-11-14/h3-4,6-7,10-11,19H,1,5,8-9,12-13H2,2H3
InChIKeyYYGGELDQRAGAQB-UHFFFAOYSA-N
MW278.42 g/mol
LogP2.16
Rot. Bonds9

About 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate

5-[methoxy(phenyl)silyl]pentyl prop-2-enoate (PubChem CID 175438813) has the molecular formula C15H22O3Si and a molecular weight of 278.42 g/mol. Its IUPAC name is 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate.

Molecular Properties

Compound Name5-[methoxy(phenyl)silyl]pentyl prop-2-enoate
PubChem CID175438813
Molecular FormulaC15H22O3Si
Molecular Weight278.42 g/mol
Exact Mass278.13
IUPAC Name5-[methoxy(phenyl)silyl]pentyl prop-2-enoate
SMILESC=CC(=O)OCCCCC[SiH](OC)c1ccccc1
InChIInChI=1S/C15H22O3Si/c1-3-15(16)18-12-8-5-9-13-19(17-2)14-10-6-4-7-11-14/h3-4,6-7,10-11,19H,1,5,8-9,12-13H2,2H3
InChIKeyYYGGELDQRAGAQB-UHFFFAOYSA-N
XLogP2.16
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

[dodecyl(phenyl)silyl] prop-2-enoate
CID 123891276
styrene;tridecyl prop-2-enoate
CID 70120047
bis(25-prop-2-enoyloxypentacosyl) benzene-1,2-dicarboxylate
CID 101299992
bis(37-prop-2-enoyloxyheptatriacontyl) benzene-1,2-dicarboxylate
CID 101300004
8-prop-2-enoyloxyoctyl prop-2-enoate
CID 12934232
4-prop-2-enoyloxybutyl prop-2-enoate;6-prop-2-enoyloxyhexyl prop-2-enoate
CID 158256375
benzoic acid;3-hydroxypropyl prop-2-enoate
CID 161094010
4-(10-prop-2-enoyloxydecoxy)benzoic acid
CID 18942550
butyl prop-2-enoate;styrene
CID 68545727
bis(butyl prop-2-enoate);styrene
CID 175337841
10-hydroxydecyl prop-2-enoate
CID 14715958
4-methoxybutyl prop-2-enoate
CID 22321356

Frequently Asked Questions

What is the IUPAC name of 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate?
The IUPAC name of 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate (CID 175438813) is 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate.
What is the SMILES notation for 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate?
The canonical SMILES for 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate is C=CC(=O)OCCCCC[SiH](OC)c1ccccc1.
What is the InChIKey of 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate?
The InChIKey is YYGGELDQRAGAQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O3Si/c1-3-15(16)18-12-8-5-9-13-19(17-2)14-10-6-4-7-11-14/h3-4,6-7,10-11,19H,1,5,8-9,12-13H2,2H3.
What are the key properties of 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate?
5-[methoxy(phenyl)silyl]pentyl prop-2-enoate has a molecular weight of 278.42 g/mol, XLogP of 2.16, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methoxy(phenyl)silyl]pentyl prop-2-enoate is sourced from PubChem (CID 175438813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).