4-hydroxybenzoic acid;tetrahydrate

C7H14O7 — CID 158154319

IUPAC4-hydroxybenzoic acid;tetrahydrate
SMILESO.O.O.O.O=C(O)c1ccc(O)cc1
InChIInChI=1S/C7H6O3.4H2O/c8-6-3-1-5(2-4-6)7(9)10;;;;/h1-4,8H,(H,9,10);4*1H2
InChIKeyFVMMATVKJWXTFV-UHFFFAOYSA-N
MW210.18 g/mol
LogP-2.21
Rot. Bonds1

About 4-hydroxybenzoic acid;tetrahydrate

4-hydroxybenzoic acid;tetrahydrate (PubChem CID 158154319) has the molecular formula C7H14O7 and a molecular weight of 210.18 g/mol. Its IUPAC name is 4-hydroxybenzoic acid;tetrahydrate.

Molecular Properties

Compound Name4-hydroxybenzoic acid;tetrahydrate
PubChem CID158154319
Molecular FormulaC7H14O7
Molecular Weight210.18 g/mol
Exact Mass210.07
IUPAC Name4-hydroxybenzoic acid;tetrahydrate
SMILESO.O.O.O.O=C(O)c1ccc(O)cc1
InChIInChI=1S/C7H6O3.4H2O/c8-6-3-1-5(2-4-6)7(9)10;;;;/h1-4,8H,(H,9,10);4*1H2
InChIKeyFVMMATVKJWXTFV-UHFFFAOYSA-N
XLogP-2.21
TPSA183.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.18
LogP ≤ 5-2.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 67150268
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Frequently Asked Questions

What is the IUPAC name of 4-hydroxybenzoic acid;tetrahydrate?
The IUPAC name of 4-hydroxybenzoic acid;tetrahydrate (CID 158154319) is 4-hydroxybenzoic acid;tetrahydrate.
What is the SMILES notation for 4-hydroxybenzoic acid;tetrahydrate?
The canonical SMILES for 4-hydroxybenzoic acid;tetrahydrate is O.O.O.O.O=C(O)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxybenzoic acid;tetrahydrate?
The InChIKey is FVMMATVKJWXTFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O3.4H2O/c8-6-3-1-5(2-4-6)7(9)10;;;;/h1-4,8H,(H,9,10);4*1H2.
What are the key properties of 4-hydroxybenzoic acid;tetrahydrate?
4-hydroxybenzoic acid;tetrahydrate has a molecular weight of 210.18 g/mol, XLogP of -2.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxybenzoic acid;tetrahydrate is sourced from PubChem (CID 158154319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).