AA52649
1214324-64-7 | Methyl 2-fluoro-3-hydroxybenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA52649
ChemicalName
Methyl 2-fluoro-3-hydroxybenzoate
CasNumber
1214324-64-7
MolecularFormula
C8H7FO3
MolecularWeight
170.1378
MdlNumber
MFCD14698042
Smiles
COC(=O)c1cccc(c1F)O
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AA52649
ChemicalName: Methyl 2-fluoro-3-hydroxybenzoate
CasNumber: 1214324-64-7
MolecularFormula: C8H7FO3
MolecularWeight: 170.1378
MdlNumber: MFCD14698042
Smiles: COC(=O)c1cccc(c1F)O
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AA52649
ChemicalName:
Methyl 2-fluoro-3-hydroxybenzoate
CasNumber:
1214324-64-7
MolecularFormula:
C8H7FO3
MolecularWeight:
170.1378
MdlNumber:
MFCD14698042
Smiles:
COC(=O)c1cccc(c1F)O
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: AA52650
ChemicalName: Methyl 3,6-difluoro-2-hydroxybenzoate
CasNumber: 1214324-50-1
MolecularFormula: C8H6F2O3
MolecularWeight: 188.1282
MdlNumber: MFCD10567189
Smiles: COC(=O)c1c(F)ccc(c1O)F
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AA52650
ChemicalName:
Methyl 3,6-difluoro-2-hydroxybenzoate
CasNumber:
1214324-50-1
MolecularFormula:
C8H6F2O3
MolecularWeight:
188.1282
MdlNumber:
MFCD10567189
Smiles:
COC(=O)c1c(F)ccc(c1O)F
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.2
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Smiles: COc1cc(cc(c1)C(=O)O)c1cccc(c1)F
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Smiles:
COc1cc(cc(c1)C(=O)O)c1cccc(c1)F
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Smiles: COC(=O)c1c(Br)cccc1C(F)(F)F
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Smiles:
COC(=O)c1c(Br)cccc1C(F)(F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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