2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid

C15H12F2O3 — CID 142375762

IUPAC2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid
SMILESCOc1ccc(C(C(=O)O)c2cc(F)cc(F)c2)cc1
InChIInChI=1S/C15H12F2O3/c1-20-13-4-2-9(3-5-13)14(15(18)19)10-6-11(16)8-12(17)7-10/h2-8,14H,1H3,(H,18,19)
InChIKeyAXORZANMPBQMEZ-UHFFFAOYSA-N
MW278.25 g/mol
LogP3.19
Rot. Bonds4

About 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid

2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid (PubChem CID 142375762) has the molecular formula C15H12F2O3 and a molecular weight of 278.25 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid
PubChem CID142375762
Molecular FormulaC15H12F2O3
Molecular Weight278.25 g/mol
Exact Mass278.08
IUPAC Name2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid
SMILESCOc1ccc(C(C(=O)O)c2cc(F)cc(F)c2)cc1
InChIInChI=1S/C15H12F2O3/c1-20-13-4-2-9(3-5-13)14(15(18)19)10-6-11(16)8-12(17)7-10/h2-8,14H,1H3,(H,18,19)
InChIKeyAXORZANMPBQMEZ-UHFFFAOYSA-N
XLogP3.19
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.25
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl carbamate;tert-butyl 2-(4-methylphenyl)-2-phenylacetate;2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid;methanamine
CID 142375776
2-(3-formylphenyl)-2-(4-methoxyphenyl)acetic acid
CID 138058935
2-(4-fluorophenyl)-2-(4-methoxyanilino)acetic acid
CID 60991336
(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid
CID 6951708
2,2-bis(3-methoxyphenyl)acetic acid
CID 67016131
3-fluoro-2-(4-methoxyphenyl)propanoic acid
CID 20555403
(3-fluoro-5-methylphenyl)-(4-methoxyphenyl)methanol
CID 79691470
(Z)-3-(3,5-difluorophenyl)-3-(4-methoxyphenyl)prop-2-enoic acid
CID 19421507
2-(3,5-difluorophenyl)-2-methoxyacetic acid
CID 22392927
ethane;2-hydroxy-2-(4-methoxyphenyl)acetic acid
CID 143238154
3-amino-1-(3,5-difluorophenyl)-2-(4-methoxyphenyl)propan-1-ol
CID 65185300
3-amino-2-(3,5-difluorophenyl)-1-(4-methoxyphenyl)propan-1-ol
CID 65189569

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid?
The IUPAC name of 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid (CID 142375762) is 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid.
What is the SMILES notation for 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid?
The canonical SMILES for 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid is COc1ccc(C(C(=O)O)c2cc(F)cc(F)c2)cc1.
What is the InChIKey of 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid?
The InChIKey is AXORZANMPBQMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2O3/c1-20-13-4-2-9(3-5-13)14(15(18)19)10-6-11(16)8-12(17)7-10/h2-8,14H,1H3,(H,18,19).
What are the key properties of 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid?
2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid has a molecular weight of 278.25 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-2-(4-methoxyphenyl)acetic acid is sourced from PubChem (CID 142375762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).