2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid

C17H13NO7 — CID 91895909

IUPAC2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid
SMILESO=NC1c2cc(OCC(=O)O)ccc2-c2ccc(OCC(=O)O)cc21
InChIInChI=1S/C17H13NO7/c19-15(20)7-24-9-1-3-11-12-4-2-10(25-8-16(21)22)6-14(12)17(18-23)13(11)5-9/h1-6,17H,7-8H2,(H,19,20)(H,21,22)
InChIKeyWUTULLQHHPLFBE-UHFFFAOYSA-N
MW343.29 g/mol
LogP2.45
Rot. Bonds7

About 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid

2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid (PubChem CID 91895909) has the molecular formula C17H13NO7 and a molecular weight of 343.29 g/mol. Its IUPAC name is 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid.

Molecular Properties

Compound Name2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid
PubChem CID91895909
Molecular FormulaC17H13NO7
Molecular Weight343.29 g/mol
Exact Mass343.07
IUPAC Name2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid
SMILESO=NC1c2cc(OCC(=O)O)ccc2-c2ccc(OCC(=O)O)cc21
InChIInChI=1S/C17H13NO7/c19-15(20)7-24-9-1-3-11-12-4-2-10(25-8-16(21)22)6-14(12)17(18-23)13(11)5-9/h1-6,17H,7-8H2,(H,19,20)(H,21,22)
InChIKeyWUTULLQHHPLFBE-UHFFFAOYSA-N
XLogP2.45
TPSA122.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.29
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid?
The IUPAC name of 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid (CID 91895909) is 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid.
What is the SMILES notation for 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid?
The canonical SMILES for 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid is O=NC1c2cc(OCC(=O)O)ccc2-c2ccc(OCC(=O)O)cc21.
What is the InChIKey of 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid?
The InChIKey is WUTULLQHHPLFBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO7/c19-15(20)7-24-9-1-3-11-12-4-2-10(25-8-16(21)22)6-14(12)17(18-23)13(11)5-9/h1-6,17H,7-8H2,(H,19,20)(H,21,22).
What are the key properties of 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid?
2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid has a molecular weight of 343.29 g/mol, XLogP of 2.45, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[7-(carboxymethoxy)-9-nitroso-9H-fluoren-2-yl]oxy]acetic acid is sourced from PubChem (CID 91895909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).