AB75884
214822-96-5 | Methyl 4-fluoro-3-hydroxybenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB75884
ChemicalName
Methyl 4-fluoro-3-hydroxybenzoate
CasNumber
214822-96-5
MolecularFormula
C8H7FO3
MolecularWeight
170.1378
MdlNumber
MFCD06797457
Smiles
COC(=O)c1ccc(c(c1)O)F
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AB75884
ChemicalName: Methyl 4-fluoro-3-hydroxybenzoate
CasNumber: 214822-96-5
MolecularFormula: C8H7FO3
MolecularWeight: 170.1378
MdlNumber: MFCD06797457
Smiles: COC(=O)c1ccc(c(c1)O)F
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AB75884
ChemicalName:
Methyl 4-fluoro-3-hydroxybenzoate
CasNumber:
214822-96-5
MolecularFormula:
C8H7FO3
MolecularWeight:
170.1378
MdlNumber:
MFCD06797457
Smiles:
COC(=O)c1ccc(c(c1)O)F
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: AB75885
ChemicalName: Methyl 4-fluoro-3-nitrobenzoate
CasNumber: 329-59-9
MolecularFormula: C8H6FNO4
MolecularWeight: 199.1359
MdlNumber: MFCD00196161
Smiles: COC(=O)c1ccc(c(c1)[N+](=O)[O-])F
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AB75885
ChemicalName:
Methyl 4-fluoro-3-nitrobenzoate
CasNumber:
329-59-9
MolecularFormula:
C8H6FNO4
MolecularWeight:
199.1359
MdlNumber:
MFCD00196161
Smiles:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])F
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1sc2c(c1)c(F)ccc2
Complexity: 234
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1sc2c(c1)c(F)ccc2
Complexity:
234
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.2
CatalogNumber: AB75887
ChemicalName: Methyl 4-fluorobenzoate
CasNumber: 403-33-8
MolecularFormula: C8H7FO2
MolecularWeight: 154.1383832
MdlNumber: MFCD00017959
Smiles: COC(=O)c1ccc(cc1)F
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AB75887
ChemicalName:
Methyl 4-fluorobenzoate
CasNumber:
403-33-8
MolecularFormula:
C8H7FO2
MolecularWeight:
154.1383832
MdlNumber:
MFCD00017959
Smiles:
COC(=O)c1ccc(cc1)F
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.3