3'-Fluoro-4'-methoxy-[1,1'-biphenyl]-4-carboxylic acid

HCID 1203166

Basic information

CAS
106291-25-2
Standard SMILES
COc1ccc(-c2ccc(C(=O)O)cc2)cc1F
InChIKey
FEZSDEWFHLIIFF-UHFFFAOYSA-N
Molecular formula
C14H11FO3
Average molar mass
246.23 g/mol
Monoisotopic mass
246.06922243

Names & identifiers

Preferred name
3'-Fluoro-4'-methoxy-[1,1'-biphenyl]-4-carboxylic acid
IUPAC
4-(3-fluoro-4-methoxyphenyl)benzoic acid
English name
3'-FLUORO-4'-METHOXYLBIPHENYL-4-CARBOXYLIC ACID
Molecular formula
C14H11FO3
Molecular weight
246.23

Names & synonyms

106291-25-24-(3-fluoro-4-methoxyphenyl)benzoic acid3'-Fluoro-4'-methoxy-[1,1'-biphenyl]-4-carboxylic acidMFCD018177303'-fluoro-4'-methoxylbiphenyl-4-carboxylic acid3'-Fluoro-4'-methoxy[1,1'-biphenyl]-4-carboxylic acid4-(3-fluoro-4-methoxy-phenyl)benzoic Acid3'-Fluoro-4'-methoxy-biphenyl-4-carboxylic acidOprea1_255905SCHEMBL36434903'-Fluoro-4'-methoxy-[1,1'-biphenyl]-4-carboxylicacidSCHEMBL30595083
Show more names
4-(5-Fluoro-2-methoxyphenyl)benzoic acid4-(3-Fluoro-5-methoxyphenyl)benzoic acid[1,1'-Biphenyl]-4-carboxylic acid, 3'-fluoro-4'-methoxy-
DTXSID20360936FEZSDEWFHLIIFF-UHFFFAOYSA-NAKOS0089672703'-fluoro-4'-methoxybiphenyl-4-carboxylic acidEN300-1585773AG-690/13701570A1-14528[1,1'-Biphenyl]-4-carboxylicacid,3'-fluoro-4'-methoxy-

Database identifiers

CAS
106291-25-2
PubChem CID
1203166
DTXSID
DTXSID20360936

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
18

Physicochemical properties

Boiling point
412.9 · 412.9±40.0 °C(Predicted)
Density
1.259 · 1.259±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
4.14 · 4.14±0.10(Predicted)

Chemistry & industry

Upstream & downstream products

Suppliers3 total

深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

10 records

Compound notes

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