formaldehyde;naphthalene-2-carboxylic acid

C12H10O3 — CID 86738660

IUPACformaldehyde;naphthalene-2-carboxylic acid
SMILESC=O.O=C(O)c1ccc2ccccc2c1
InChIInChI=1S/C11H8O2.CH2O/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;1-2/h1-7H,(H,12,13);1H2
InChIKeyFLRATBBXTRUEPF-UHFFFAOYSA-N
MW202.21 g/mol
LogP2.35
Rot. Bonds1

About formaldehyde;naphthalene-2-carboxylic acid

formaldehyde;naphthalene-2-carboxylic acid (PubChem CID 86738660) has the molecular formula C12H10O3 and a molecular weight of 202.21 g/mol. Its IUPAC name is formaldehyde;naphthalene-2-carboxylic acid.

Molecular Properties

Compound Nameformaldehyde;naphthalene-2-carboxylic acid
PubChem CID86738660
Molecular FormulaC12H10O3
Molecular Weight202.21 g/mol
Exact Mass202.06
IUPAC Nameformaldehyde;naphthalene-2-carboxylic acid
SMILESC=O.O=C(O)c1ccc2ccccc2c1
InChIInChI=1S/C11H8O2.CH2O/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;1-2/h1-7H,(H,12,13);1H2
InChIKeyFLRATBBXTRUEPF-UHFFFAOYSA-N
XLogP2.35
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

naphthalene-2-carboxylic acid
CID 175967775
naphthalene-2-carboxylic acid;dihydrochloride
CID 70357946
hexacene-2-carboxylic acid
CID 87430666
ethene;naphthalene-2,6-dicarboxylic acid
CID 66988682
naphthalene-2-carboxylic acid;naphthalen-2-ol
CID 161405760
ethane;naphthalene-2-carboxylic acid;propane
CID 143443534
bis(naphthalene-2,6-dicarboxylic acid);zirconium
CID 162353964
CID 67200510
CID 67200510
naphthalene-2,6-dicarboxylic acid;thorium
CID 175461115
naphthalene-2,7-dicarboxylic acid;hydrobromide
CID 175255726
magnesium;hydride;naphthalene-2,6-dicarboxylic acid
CID 173052863
1-naphthalen-2-yl-2-[4-(2-naphthalen-2-yl-2-oxoacetyl)phenyl]ethane-1,2-dione
CID 10939145

Frequently Asked Questions

What is the IUPAC name of formaldehyde;naphthalene-2-carboxylic acid?
The IUPAC name of formaldehyde;naphthalene-2-carboxylic acid (CID 86738660) is formaldehyde;naphthalene-2-carboxylic acid.
What is the SMILES notation for formaldehyde;naphthalene-2-carboxylic acid?
The canonical SMILES for formaldehyde;naphthalene-2-carboxylic acid is C=O.O=C(O)c1ccc2ccccc2c1.
What is the InChIKey of formaldehyde;naphthalene-2-carboxylic acid?
The InChIKey is FLRATBBXTRUEPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8O2.CH2O/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;1-2/h1-7H,(H,12,13);1H2.
What are the key properties of formaldehyde;naphthalene-2-carboxylic acid?
formaldehyde;naphthalene-2-carboxylic acid has a molecular weight of 202.21 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;naphthalene-2-carboxylic acid is sourced from PubChem (CID 86738660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).