CID 102150681

C17H14O3- — CID 102150681

IUPAC—
SMILESCC(C)(C)c1cc2c(c([O-])c1[O])C(=O)c1ccccc1-2
InChIInChI=1S/C17H15O3/c1-17(2,3)12-8-11-9-6-4-5-7-10(9)14(18)13(11)16(20)15(12)19/h4-8,20H,1-3H3/p-1
InChIKeyKPRGSOYVSJQYAQ-UHFFFAOYSA-M
MW266.30 g/mol
LogP3.41
Rot. Bonds

About CID 102150681

CID 102150681 (PubChem CID 102150681) has the molecular formula C17H14O3- and a molecular weight of 266.30 g/mol.

Molecular Properties

Compound NameCID 102150681
PubChem CID102150681
Molecular FormulaC17H14O3-
Molecular Weight266.30 g/mol
Exact Mass266.09
IUPAC Name—
SMILESCC(C)(C)c1cc2c(c([O-])c1[O])C(=O)c1ccccc1-2
InChIInChI=1S/C17H15O3/c1-17(2,3)12-8-11-9-6-4-5-7-10(9)14(18)13(11)16(20)15(12)19/h4-8,20H,1-3H3/p-1
InChIKeyKPRGSOYVSJQYAQ-UHFFFAOYSA-M
XLogP3.41
TPSA60.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 102150681?
The IUPAC name of CID 102150681 (CID 102150681) is not available.
What is the SMILES notation for CID 102150681?
The canonical SMILES for CID 102150681 is CC(C)(C)c1cc2c(c([O-])c1[O])C(=O)c1ccccc1-2.
What is the InChIKey of CID 102150681?
The InChIKey is KPRGSOYVSJQYAQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C17H15O3/c1-17(2,3)12-8-11-9-6-4-5-7-10(9)14(18)13(11)16(20)15(12)19/h4-8,20H,1-3H3/p-1.
What are the key properties of CID 102150681?
CID 102150681 has a molecular weight of 266.30 g/mol, XLogP of 3.41, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102150681 is sourced from PubChem (CID 102150681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).