CID 19043998

C15H31O5Si3 — CID 19043998

IUPAC—
SMILESCCCCOC(C)C(OCCCC)(OCCCC)[Si]O[Si]O[Si]
InChIInChI=1S/C15H31O5Si3/c1-5-8-11-16-14(4)15(17-12-9-6-2,18-13-10-7-3)22-20-23-19-21/h14H,5-13H2,1-4H3
InChIKeyAHWSRHNFBKXCCH-UHFFFAOYSA-N
MW375.67 g/mol
LogP2.75
Rot. Bonds17

About CID 19043998

CID 19043998 (PubChem CID 19043998) has the molecular formula C15H31O5Si3 and a molecular weight of 375.67 g/mol.

Molecular Properties

Compound NameCID 19043998
PubChem CID19043998
Molecular FormulaC15H31O5Si3
Molecular Weight375.67 g/mol
Exact Mass375.15
IUPAC Name—
SMILESCCCCOC(C)C(OCCCC)(OCCCC)[Si]O[Si]O[Si]
InChIInChI=1S/C15H31O5Si3/c1-5-8-11-16-14(4)15(17-12-9-6-2,18-13-10-7-3)22-20-23-19-21/h14H,5-13H2,1-4H3
InChIKeyAHWSRHNFBKXCCH-UHFFFAOYSA-N
XLogP2.75
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds17
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.67
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

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1-propan-2-yloxybutane;zirconium
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methane;1-propan-2-yloxybutane
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dimethoxy-(methoxymethoxy)-(1,1,2-tributoxypropyl)silane
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1,1,3,3-tetrabutoxypropan-2-one
CID 546234
1-butoxyethanol;1-butoxypropan-1-ol
CID 161420365
1-butan-2-yloxy-5-butoxy-5-methylheptane
CID 173302363
1-(1,1,2,2-tetrabromoethoxy)butane
CID 134894303
CID 87144868
CID 87144868
bis(2,2,3-tributoxybutanedioate);zirconium(4+)
CID 157401809
CID 136849236
CID 136849236
CID 136849214
CID 136849214

Frequently Asked Questions

What is the IUPAC name of CID 19043998?
The IUPAC name of CID 19043998 (CID 19043998) is not available.
What is the SMILES notation for CID 19043998?
The canonical SMILES for CID 19043998 is CCCCOC(C)C(OCCCC)(OCCCC)[Si]O[Si]O[Si].
What is the InChIKey of CID 19043998?
The InChIKey is AHWSRHNFBKXCCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31O5Si3/c1-5-8-11-16-14(4)15(17-12-9-6-2,18-13-10-7-3)22-20-23-19-21/h14H,5-13H2,1-4H3.
What are the key properties of CID 19043998?
CID 19043998 has a molecular weight of 375.67 g/mol, XLogP of 2.75, 17 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19043998 is sourced from PubChem (CID 19043998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).