4-morpholin-4-yloxybenzoic acid

C11H13NO4 — CID 118058764

IUPAC4-morpholin-4-yloxybenzoic acid
SMILESO=C(O)c1ccc(ON2CCOCC2)cc1
InChIInChI=1S/C11H13NO4/c13-11(14)9-1-3-10(4-2-9)16-12-5-7-15-8-6-12/h1-4H,5-8H2,(H,13,14)
InChIKeyOKEMJFMSJSKYAW-UHFFFAOYSA-N
MW223.23 g/mol
LogP1.01
Rot. Bonds3

About 4-morpholin-4-yloxybenzoic acid

4-morpholin-4-yloxybenzoic acid (PubChem CID 118058764) has the molecular formula C11H13NO4 and a molecular weight of 223.23 g/mol. Its IUPAC name is 4-morpholin-4-yloxybenzoic acid.

Molecular Properties

Compound Name4-morpholin-4-yloxybenzoic acid
PubChem CID118058764
Molecular FormulaC11H13NO4
Molecular Weight223.23 g/mol
Exact Mass223.08
IUPAC Name4-morpholin-4-yloxybenzoic acid
SMILESO=C(O)c1ccc(ON2CCOCC2)cc1
InChIInChI=1S/C11H13NO4/c13-11(14)9-1-3-10(4-2-9)16-12-5-7-15-8-6-12/h1-4H,5-8H2,(H,13,14)
InChIKeyOKEMJFMSJSKYAW-UHFFFAOYSA-N
XLogP1.01
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

terephthalic acid;dihydrofluoride
CID 70485309
hexakis(4-aminobenzoic acid);tris(1,4,7,10,13,16-hexaoxacyclooctadecane)
CID 139064226
4-[4-[4-(4-carboxyphenoxy)phenoxy]phenoxy]benzoic acid
CID 14177974
4-(4-methylpiperazin-1-yl)oxybenzamide
CID 141124699
4-[chloro(morpholin-4-yl)methyl]benzoic acid
CID 174920525
terephthalic acid
CID 160582437
4-[[(2S,3S)-3-(4-carboxyphenoxy)-1,4-dioxan-2-yl]oxy]benzoic acid
CID 2311273
4-[(3R)-oxolan-3-yl]oxybenzoic acid
CID 95979365
bis(4-aminobenzoic acid);oxolane
CID 66588912
CID 11115840
CID 11115840
4-[4-[7-[13-[7-[4-(4-carboxyphenoxy)carbonylphenoxy]heptyl]-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]heptoxy]benzoyl]oxybenzoic acid
CID 102428299
(4-methoxyphenyl)-(4-morpholin-4-ylphenyl)methanone
CID 22731230

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yloxybenzoic acid?
The IUPAC name of 4-morpholin-4-yloxybenzoic acid (CID 118058764) is 4-morpholin-4-yloxybenzoic acid.
What is the SMILES notation for 4-morpholin-4-yloxybenzoic acid?
The canonical SMILES for 4-morpholin-4-yloxybenzoic acid is O=C(O)c1ccc(ON2CCOCC2)cc1.
What is the InChIKey of 4-morpholin-4-yloxybenzoic acid?
The InChIKey is OKEMJFMSJSKYAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO4/c13-11(14)9-1-3-10(4-2-9)16-12-5-7-15-8-6-12/h1-4H,5-8H2,(H,13,14).
What are the key properties of 4-morpholin-4-yloxybenzoic acid?
4-morpholin-4-yloxybenzoic acid has a molecular weight of 223.23 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yloxybenzoic acid is sourced from PubChem (CID 118058764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).