AA36428

1261964-10-6 | 4-(4-Carboxy-3-fluorophenyl)-3-methylbenzoic acid

Manufacturer: A2B Chem

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CatalogNumber

AA36428

ChemicalName

4-(4-Carboxy-3-fluorophenyl)-3-methylbenzoic acid

CasNumber

1261964-10-6

MolecularFormula

C15H11FO4

MolecularWeight

274.2438432

MdlNumber

MFCD18321491

Smiles

Cc1cc(ccc1c1ccc(c(c1)F)C(=O)O)C(=O)O

Complexity

384

Covalently-bondedUnitCount

1

HeavyAtomCount

20

HydrogenBondAcceptorCount

5

HydrogenBondDonorCount

2

RotatableBondCount

3

Xlogp3

3.1

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A2B Chem

AA36428

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CatalogNumber:
AA36428

ChemicalName:
4-(4-Carboxy-3-fluorophenyl)-3-methylbenzoic acid

CasNumber:
1261964-10-6

MolecularFormula:
C15H11FO4

MolecularWeight:
274.2438432

MdlNumber:
MFCD18321491

Smiles:
Cc1cc(ccc1c1ccc(c(c1)F)C(=O)O)C(=O)O

Complexity:
384

Covalently-bondedUnitCount:
1

HeavyAtomCount:
20

HydrogenBondAcceptorCount:
5

HydrogenBondDonorCount:
2

RotatableBondCount:
3

Xlogp3:
3.1

Img

A2B Chem

AA36429

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
Clc1ccc(cc1)c1cc(cc(c1)C(F)(F)F)C(=O)O

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA36430

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CatalogNumber:
AA36430

ChemicalName:
5-(2-Methylthiophenyl)nicotinic acid

CasNumber:
1261964-02-6

MolecularFormula:
C13H11NO2S

MolecularWeight:
245.2969

MdlNumber:
MFCD18317425

Smiles:
CSc1ccccc1c1cncc(c1)C(=O)O

Complexity:
272

Covalently-bondedUnitCount:
1

HeavyAtomCount:
17

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
1

RotatableBondCount:
3

Xlogp3:
2.5

Img

A2B Chem

AA36431

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CatalogNumber:
AA36431

ChemicalName:
3-(3-Fluoro-2-methylphenyl)-5-nitrobenzoic acid

CasNumber:
1261962-57-5

MolecularFormula:
C14H10FNO4

MolecularWeight:
275.2319

MdlNumber:
MFCD18319618

Smiles:
OC(=O)c1cc(cc(c1)c1cccc(c1C)F)[N+](=O)[O-]

Complexity:
384

Covalently-bondedUnitCount:
1

HeavyAtomCount:
20

HydrogenBondAcceptorCount:
5

HydrogenBondDonorCount:
1

RotatableBondCount:
2

Xlogp3:
3.4