formaldehyde;4-hydroxybenzoic acid

C8H8O4 — CID 68624082

IUPACformaldehyde;4-hydroxybenzoic acid
SMILESC=O.O=C(O)c1ccc(O)cc1
InChIInChI=1S/C7H6O3.CH2O/c8-6-3-1-5(2-4-6)7(9)10;1-2/h1-4,8H,(H,9,10);1H2
InChIKeyLKRSCNTVLMFZFK-UHFFFAOYSA-N
MW168.15 g/mol
LogP0.91
Rot. Bonds1

About formaldehyde;4-hydroxybenzoic acid

formaldehyde;4-hydroxybenzoic acid (PubChem CID 68624082) has the molecular formula C8H8O4 and a molecular weight of 168.15 g/mol. Its IUPAC name is formaldehyde;4-hydroxybenzoic acid.

Molecular Properties

Compound Nameformaldehyde;4-hydroxybenzoic acid
PubChem CID68624082
Molecular FormulaC8H8O4
Molecular Weight168.15 g/mol
Exact Mass168.04
IUPAC Nameformaldehyde;4-hydroxybenzoic acid
SMILESC=O.O=C(O)c1ccc(O)cc1
InChIInChI=1S/C7H6O3.CH2O/c8-6-3-1-5(2-4-6)7(9)10;1-2/h1-4,8H,(H,9,10);1H2
InChIKeyLKRSCNTVLMFZFK-UHFFFAOYSA-N
XLogP0.91
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.15
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethene;bis(4-hydroxybenzoic acid)
CID 158613514
4-hydroxy(11C)benzoic acid
CID 11275035
4-hydroxybenzoic acid;silver
CID 88784168
4-hydroxybenzoic acid;decahydrate
CID 140502755
4-hydroxybenzoic acid;tetrahydrate
CID 158154319
sodium;4-hydroxybenzoic acid;hydroxide
CID 161288203
benzene-1,4-diol;benzoic acid
CID 67019242
acetamide;4-hydroxybenzoic acid
CID 67150268
ethane;4-(4-hydroxyphenyl)benzoic acid
CID 91010322
ethene;terephthalic acid
CID 18755810
terephthalic acid
CID 160582437
sodium;4-hydroxybenzoic acid;nitrite
CID 139461106

Frequently Asked Questions

What is the IUPAC name of formaldehyde;4-hydroxybenzoic acid?
The IUPAC name of formaldehyde;4-hydroxybenzoic acid (CID 68624082) is formaldehyde;4-hydroxybenzoic acid.
What is the SMILES notation for formaldehyde;4-hydroxybenzoic acid?
The canonical SMILES for formaldehyde;4-hydroxybenzoic acid is C=O.O=C(O)c1ccc(O)cc1.
What is the InChIKey of formaldehyde;4-hydroxybenzoic acid?
The InChIKey is LKRSCNTVLMFZFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O3.CH2O/c8-6-3-1-5(2-4-6)7(9)10;1-2/h1-4,8H,(H,9,10);1H2.
What are the key properties of formaldehyde;4-hydroxybenzoic acid?
formaldehyde;4-hydroxybenzoic acid has a molecular weight of 168.15 g/mol, XLogP of 0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;4-hydroxybenzoic acid is sourced from PubChem (CID 68624082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).