CID 102007434

C10H7O4 — CID 102007434

IUPAC—
SMILESO=C1C=C[C](O)c2c(O)ccc(O)c21
InChIInChI=1S/C10H7O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-13H
InChIKeyQNMFWHCJVQZQKK-UHFFFAOYSA-N
MW191.16 g/mol
LogP1.10
Rot. Bonds

About CID 102007434

CID 102007434 (PubChem CID 102007434) has the molecular formula C10H7O4 and a molecular weight of 191.16 g/mol.

Molecular Properties

Compound NameCID 102007434
PubChem CID102007434
Molecular FormulaC10H7O4
Molecular Weight191.16 g/mol
Exact Mass191.03
IUPAC Name—
SMILESO=C1C=C[C](O)c2c(O)ccc(O)c21
InChIInChI=1S/C10H7O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-13H
InChIKeyQNMFWHCJVQZQKK-UHFFFAOYSA-N
XLogP1.10
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 102007434?
The IUPAC name of CID 102007434 (CID 102007434) is not available.
What is the SMILES notation for CID 102007434?
The canonical SMILES for CID 102007434 is O=C1C=C[C](O)c2c(O)ccc(O)c21.
What is the InChIKey of CID 102007434?
The InChIKey is QNMFWHCJVQZQKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-13H.
What are the key properties of CID 102007434?
CID 102007434 has a molecular weight of 191.16 g/mol, XLogP of 1.10, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102007434 is sourced from PubChem (CID 102007434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).