[2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate

C17H38O6Si3 — CID 87222684

IUPAC[2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(O)COC(CC)[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C17H38O6Si3/c1-11-16(20-12-15(18)13-21-17(19)14(2)3)26(10,22-24(4,5)6)23-25(7,8)9/h15-16,18H,2,11-13H2,1,3-10H3
InChIKeyRYSHRLRCQHIDMW-UHFFFAOYSA-N
MW422.74 g/mol
LogP3.58
Rot. Bonds12

About [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate

[2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate (PubChem CID 87222684) has the molecular formula C17H38O6Si3 and a molecular weight of 422.74 g/mol. Its IUPAC name is [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate
PubChem CID87222684
Molecular FormulaC17H38O6Si3
Molecular Weight422.74 g/mol
Exact Mass422.20
IUPAC Name[2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(O)COC(CC)[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C17H38O6Si3/c1-11-16(20-12-15(18)13-21-17(19)14(2)3)26(10,22-24(4,5)6)23-25(7,8)9/h15-16,18H,2,11-13H2,1,3-10H3
InChIKeyRYSHRLRCQHIDMW-UHFFFAOYSA-N
XLogP3.58
TPSA74.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.74
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[2-hydroxy-3-[1-tris(trimethylsilyloxy)silylpropoxy]propyl] 2-methylprop-2-enoate
CID 22134039
[2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate
CID 118855687
[2-hydroxy-4-[propyl-bis(trimethylsilyloxy)silyl]butyl] 2-methylprop-2-enoate
CID 160516479
(2-hydroxy-3-propanoyloxypropyl) 2-methylprop-2-enoate
CID 20746567
(2-hydroxy-3-methoxypropyl) 2-methylprop-2-enoate
CID 15315335
[2-hydroxy-4-(methoxy-methyl-trimethylsilyloxysilyl)butyl] 2-methylprop-2-enoate
CID 58512799
(2-hydroxy-3-methoxycarbonyloxypropyl) 2-methylprop-2-enoate
CID 139917348
2,3-dihydroxypropyl 2-methylprop-2-enoate;propane
CID 87556862
[2-hydroxy-3-[3-[methyl-(2-methylprop-2-enoyloxy)-trimethylsilyloxysilyl]propoxy]propyl] 2-methylprop-2-enoate
CID 140749715
[2-hydroxy-3-[2-[2-[2-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]ethoxy]ethoxy]ethoxy]propyl] 2-methylprop-2-enoate
CID 12800792
diethyl-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl]-methylazanium chloride
CID 19800674
[3-[2-(butan-2-ylamino)propanoyloxy]-2-hydroxypropyl] 2-methylprop-2-enoate
CID 139382686

Frequently Asked Questions

What is the IUPAC name of [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate?
The IUPAC name of [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate (CID 87222684) is [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate.
What is the SMILES notation for [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate?
The canonical SMILES for [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate is C=C(C)C(=O)OCC(O)COC(CC)[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate?
The InChIKey is RYSHRLRCQHIDMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38O6Si3/c1-11-16(20-12-15(18)13-21-17(19)14(2)3)26(10,22-24(4,5)6)23-25(7,8)9/h15-16,18H,2,11-13H2,1,3-10H3.
What are the key properties of [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate?
[2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate has a molecular weight of 422.74 g/mol, XLogP of 3.58, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate is sourced from PubChem (CID 87222684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).