phthalic acid;silicic acid

C8H10O8Si — CID 159320374

IUPACphthalic acid;silicic acid
SMILESO=C(O)c1ccccc1C(=O)O.O[Si](O)(O)O
InChIInChI=1S/C8H6O4.H4O4Si/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);1-4H
InChIKeyLDRKIPKWQPPBNM-UHFFFAOYSA-N
MW262.25 g/mol
LogP-1.53
Rot. Bonds2

About phthalic acid;silicic acid

phthalic acid;silicic acid (PubChem CID 159320374) has the molecular formula C8H10O8Si and a molecular weight of 262.25 g/mol. Its IUPAC name is phthalic acid;silicic acid.

Molecular Properties

Compound Namephthalic acid;silicic acid
PubChem CID159320374
Molecular FormulaC8H10O8Si
Molecular Weight262.25 g/mol
Exact Mass262.01
IUPAC Namephthalic acid;silicic acid
SMILESO=C(O)c1ccccc1C(=O)O.O[Si](O)(O)O
InChIInChI=1S/C8H6O4.H4O4Si/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);1-4H
InChIKeyLDRKIPKWQPPBNM-UHFFFAOYSA-N
XLogP-1.53
TPSA155.52 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.25
LogP ≤ 5-1.53
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

hydroxy(trimethyl)silane;phthalic acid
CID 175037657
hydron;phthalic acid
CID 67386665
CID 66717184
CID 66717184
phthalic acid;hydrobromide
CID 71236392
bis(oxygen(2-));phthalic acid;titanium(4+)
CID 161084506
barium(2+);hydride;phthalic acid
CID 173000011
hydride;phthalic acid;rubidium(1+)
CID 173256629
magnesium;hydride;phthalic acid
CID 173000994
dilithium;hydride;phthalic acid
CID 173011412
benzene-1,2,4,5-tetracarboxylic acid;phthalic acid
CID 174433443
formaldehyde;phthalic acid
CID 174659618
azane;phthalic acid;hydrochloride
CID 175440203

Frequently Asked Questions

What is the IUPAC name of phthalic acid;silicic acid?
The IUPAC name of phthalic acid;silicic acid (CID 159320374) is phthalic acid;silicic acid.
What is the SMILES notation for phthalic acid;silicic acid?
The canonical SMILES for phthalic acid;silicic acid is O=C(O)c1ccccc1C(=O)O.O[Si](O)(O)O.
What is the InChIKey of phthalic acid;silicic acid?
The InChIKey is LDRKIPKWQPPBNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O4.H4O4Si/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);1-4H.
What are the key properties of phthalic acid;silicic acid?
phthalic acid;silicic acid has a molecular weight of 262.25 g/mol, XLogP of -1.53, 2 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for phthalic acid;silicic acid is sourced from PubChem (CID 159320374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).