AE62470
1375068-82-8 | 5-[3-(Carboxymethyl)phenyl]-2-fluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AE62470
ChemicalName
5-[3-(Carboxymethyl)phenyl]-2-fluorobenzoic acid
CasNumber
1375068-82-8
MolecularFormula
C15H11FO4
MolecularWeight
274.2438
MdlNumber
MFCD22205805
Smiles
OC(=O)Cc1cccc(c1)c1ccc(c(c1)C(=O)O)F
Complexity
371
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
2.6
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CatalogNumber: AE62470
ChemicalName: 5-[3-(Carboxymethyl)phenyl]-2-fluorobenzoic acid
CasNumber: 1375068-82-8
MolecularFormula: C15H11FO4
MolecularWeight: 274.2438
MdlNumber: MFCD22205805
Smiles: OC(=O)Cc1cccc(c1)c1ccc(c(c1)C(=O)O)F
Complexity: 371
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 2.6
CatalogNumber:
AE62470
ChemicalName:
5-[3-(Carboxymethyl)phenyl]-2-fluorobenzoic acid
CasNumber:
1375068-82-8
MolecularFormula:
C15H11FO4
MolecularWeight:
274.2438
MdlNumber:
MFCD22205805
Smiles:
OC(=O)Cc1cccc(c1)c1ccc(c(c1)C(=O)O)F
Complexity:
371
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
2.6
CatalogNumber: AE62471
ChemicalName: 3-Carboxymethyl-3'-(pyrrolidinocarbony)biphenyl
CasNumber: 1375069-22-9
MolecularFormula: C19H19NO3
MolecularWeight: 309.3591
MdlNumber: MFCD22205797
Smiles: OC(=O)Cc1cccc(c1)c1cccc(c1)C(=O)N1CCCC1
Complexity: 430
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3
CatalogNumber:
AE62471
ChemicalName:
3-Carboxymethyl-3'-(pyrrolidinocarbony)biphenyl
CasNumber:
1375069-22-9
MolecularFormula:
C19H19NO3
MolecularWeight:
309.3591
MdlNumber:
MFCD22205797
Smiles:
OC(=O)Cc1cccc(c1)c1cccc(c1)C(=O)N1CCCC1
Complexity:
430
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3
CatalogNumber: AE62472
ChemicalName: 4-(3-Carboxyphenyl)-2-methylphenol
CasNumber: 1261976-44-6
MolecularFormula: C14H12O3
MolecularWeight: 228.2433
MdlNumber: MFCD18313223
Smiles: OC(=O)c1cccc(c1)c1ccc(c(c1)C)O
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AE62472
ChemicalName:
4-(3-Carboxyphenyl)-2-methylphenol
CasNumber:
1261976-44-6
MolecularFormula:
C14H12O3
MolecularWeight:
228.2433
MdlNumber:
MFCD18313223
Smiles:
OC(=O)c1cccc(c1)c1ccc(c(c1)C)O
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
3.1
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Smiles: Oc1cc(Cl)cc(c1)c1csc(c1)C(=O)O
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Oc1cc(Cl)cc(c1)c1csc(c1)C(=O)O
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