carbonic acid;naphthalene

C12H12O6 — CID 23113462

IUPACcarbonic acid;naphthalene
SMILESO=C(O)O.O=C(O)O.c1ccc2ccccc2c1
InChIInChI=1S/C10H8.2CH2O3/c1-2-6-10-8-4-3-7-9(10)5-1;2*2-1(3)4/h1-8H;2*(H2,2,3,4)
InChIKeyOCIWXMRDXZCSRH-UHFFFAOYSA-N
MW252.22 g/mol
LogP3.28
Rot. Bonds

About carbonic acid;naphthalene

carbonic acid;naphthalene (PubChem CID 23113462) has the molecular formula C12H12O6 and a molecular weight of 252.22 g/mol. Its IUPAC name is carbonic acid;naphthalene.

Molecular Properties

Compound Namecarbonic acid;naphthalene
PubChem CID23113462
Molecular FormulaC12H12O6
Molecular Weight252.22 g/mol
Exact Mass252.06
IUPAC Namecarbonic acid;naphthalene
SMILESO=C(O)O.O=C(O)O.c1ccc2ccccc2c1
InChIInChI=1S/C10H8.2CH2O3/c1-2-6-10-8-4-3-7-9(10)5-1;2*2-1(3)4/h1-8H;2*(H2,2,3,4)
InChIKeyOCIWXMRDXZCSRH-UHFFFAOYSA-N
XLogP3.28
TPSA115.06 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.22
LogP ≤ 53.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of carbonic acid;naphthalene?
The IUPAC name of carbonic acid;naphthalene (CID 23113462) is carbonic acid;naphthalene.
What is the SMILES notation for carbonic acid;naphthalene?
The canonical SMILES for carbonic acid;naphthalene is O=C(O)O.O=C(O)O.c1ccc2ccccc2c1.
What is the InChIKey of carbonic acid;naphthalene?
The InChIKey is OCIWXMRDXZCSRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8.2CH2O3/c1-2-6-10-8-4-3-7-9(10)5-1;2*2-1(3)4/h1-8H;2*(H2,2,3,4).
What are the key properties of carbonic acid;naphthalene?
carbonic acid;naphthalene has a molecular weight of 252.22 g/mol, XLogP of 3.28, 0 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;naphthalene is sourced from PubChem (CID 23113462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).