AI59745
889950-25-8 | Methyl 3-(6-aminopyridin-3-yl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AI59745
ChemicalName
Methyl 3-(6-aminopyridin-3-yl)benzoate
CasNumber
889950-25-8
MolecularFormula
C13H12N2O2
MolecularWeight
228.2466
MdlNumber
MFCD06802150
Smiles
COC(=O)c1cccc(c1)c1ccc(nc1)N
Complexity
270
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2
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CatalogNumber: AI59745
ChemicalName: Methyl 3-(6-aminopyridin-3-yl)benzoate
CasNumber: 889950-25-8
MolecularFormula: C13H12N2O2
MolecularWeight: 228.2466
MdlNumber: MFCD06802150
Smiles: COC(=O)c1cccc(c1)c1ccc(nc1)N
Complexity: 270
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AI59745
ChemicalName:
Methyl 3-(6-aminopyridin-3-yl)benzoate
CasNumber:
889950-25-8
MolecularFormula:
C13H12N2O2
MolecularWeight:
228.2466
MdlNumber:
MFCD06802150
Smiles:
COC(=O)c1cccc(c1)c1ccc(nc1)N
Complexity:
270
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2
CatalogNumber: AI59746
ChemicalName: 4-(3-Benzyloxyphenyl)phenol
CasNumber: 889950-85-0
MolecularFormula: C19H16O2
MolecularWeight: 276.3291
MdlNumber: MFCD06802269
Smiles: Oc1ccc(cc1)c1cccc(c1)OCc1ccccc1
Complexity: 290
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 4.7
CatalogNumber:
AI59746
ChemicalName:
4-(3-Benzyloxyphenyl)phenol
CasNumber:
889950-85-0
MolecularFormula:
C19H16O2
MolecularWeight:
276.3291
MdlNumber:
MFCD06802269
Smiles:
Oc1ccc(cc1)c1cccc(c1)OCc1ccccc1
Complexity:
290
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
4.7
CatalogNumber: AI59747
ChemicalName: 3-(3-Benzyloxyphenyl)phenol
CasNumber: 889950-90-7
MolecularFormula: C19H16O2
MolecularWeight: 276.3291
MdlNumber: MFCD06802270
Smiles: Oc1cccc(c1)c1cccc(c1)OCc1ccccc1
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 4.7
CatalogNumber:
AI59747
ChemicalName:
3-(3-Benzyloxyphenyl)phenol
CasNumber:
889950-90-7
MolecularFormula:
C19H16O2
MolecularWeight:
276.3291
MdlNumber:
MFCD06802270
Smiles:
Oc1cccc(c1)c1cccc(c1)OCc1ccccc1
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
4.7
CatalogNumber: AI59748
ChemicalName: 2-(3-Benzyloxyphenyl)phenol
CasNumber: 889950-96-3
MolecularFormula: C19H16O2
MolecularWeight: 276.3291
MdlNumber: MFCD06802271
Smiles: Oc1ccccc1c1cccc(c1)OCc1ccccc1
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 4.6
CatalogNumber:
AI59748
ChemicalName:
2-(3-Benzyloxyphenyl)phenol
CasNumber:
889950-96-3
MolecularFormula:
C19H16O2
MolecularWeight:
276.3291
MdlNumber:
MFCD06802271
Smiles:
Oc1ccccc1c1cccc(c1)OCc1ccccc1
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
4.6