hydroxy(trimethyl)silane;phthalic acid

C11H16O5Si — CID 175037657

IUPAChydroxy(trimethyl)silane;phthalic acid
SMILESC[Si](C)(C)O.O=C(O)c1ccccc1C(=O)O
InChIInChI=1S/C8H6O4.C3H10OSi/c9-7(10)5-3-1-2-4-6(5)8(11)12;1-5(2,3)4/h1-4H,(H,9,10)(H,11,12);4H,1-3H3
InChIKeyMHENOEJDYKYCJG-UHFFFAOYSA-N
MW256.33 g/mol
LogP1.90
Rot. Bonds2

About hydroxy(trimethyl)silane;phthalic acid

hydroxy(trimethyl)silane;phthalic acid (PubChem CID 175037657) has the molecular formula C11H16O5Si and a molecular weight of 256.33 g/mol. Its IUPAC name is hydroxy(trimethyl)silane;phthalic acid.

Molecular Properties

Compound Namehydroxy(trimethyl)silane;phthalic acid
PubChem CID175037657
Molecular FormulaC11H16O5Si
Molecular Weight256.33 g/mol
Exact Mass256.08
IUPAC Namehydroxy(trimethyl)silane;phthalic acid
SMILESC[Si](C)(C)O.O=C(O)c1ccccc1C(=O)O
InChIInChI=1S/C8H6O4.C3H10OSi/c9-7(10)5-3-1-2-4-6(5)8(11)12;1-5(2,3)4/h1-4H,(H,9,10)(H,11,12);4H,1-3H3
InChIKeyMHENOEJDYKYCJG-UHFFFAOYSA-N
XLogP1.90
TPSA94.83 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 159320374
hydron;phthalic acid
CID 67386665
CID 66717184
CID 66717184
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CID 71236392
CID 174469049
CID 174469049
benzene-1,2,4,5-tetracarboxylic acid;phthalic acid
CID 174433443
dilithium;hydride;phthalic acid
CID 173011412
hydride;phthalic acid;rubidium(1+)
CID 173256629
magnesium;hydride;phthalic acid
CID 173000994
barium(2+);hydride;phthalic acid
CID 173000011
bis(oxygen(2-));phthalic acid;titanium(4+)
CID 161084506
formaldehyde;phthalic acid
CID 174659618

Frequently Asked Questions

What is the IUPAC name of hydroxy(trimethyl)silane;phthalic acid?
The IUPAC name of hydroxy(trimethyl)silane;phthalic acid (CID 175037657) is hydroxy(trimethyl)silane;phthalic acid.
What is the SMILES notation for hydroxy(trimethyl)silane;phthalic acid?
The canonical SMILES for hydroxy(trimethyl)silane;phthalic acid is C[Si](C)(C)O.O=C(O)c1ccccc1C(=O)O.
What is the InChIKey of hydroxy(trimethyl)silane;phthalic acid?
The InChIKey is MHENOEJDYKYCJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O4.C3H10OSi/c9-7(10)5-3-1-2-4-6(5)8(11)12;1-5(2,3)4/h1-4H,(H,9,10)(H,11,12);4H,1-3H3.
What are the key properties of hydroxy(trimethyl)silane;phthalic acid?
hydroxy(trimethyl)silane;phthalic acid has a molecular weight of 256.33 g/mol, XLogP of 1.90, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy(trimethyl)silane;phthalic acid is sourced from PubChem (CID 175037657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).