AE62465
1261990-34-4 | 4-(4-Carboxy-3-fluorophenyl)-2-methoxyphenol
Manufacturer: A2B Chem
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CatalogNumber
AE62465
ChemicalName
4-(4-Carboxy-3-fluorophenyl)-2-methoxyphenol
CasNumber
1261990-34-4
MolecularFormula
C14H11FO4
MolecularWeight
262.2331
MdlNumber
MFCD18315233
Smiles
COc1cc(ccc1O)c1ccc(c(c1)F)C(=O)O
Complexity
323
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AE62465
ChemicalName: 4-(4-Carboxy-3-fluorophenyl)-2-methoxyphenol
CasNumber: 1261990-34-4
MolecularFormula: C14H11FO4
MolecularWeight: 262.2331
MdlNumber: MFCD18315233
Smiles: COc1cc(ccc1O)c1ccc(c(c1)F)C(=O)O
Complexity: 323
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AE62465
ChemicalName:
4-(4-Carboxy-3-fluorophenyl)-2-methoxyphenol
CasNumber:
1261990-34-4
MolecularFormula:
C14H11FO4
MolecularWeight:
262.2331
MdlNumber:
MFCD18315233
Smiles:
COc1cc(ccc1O)c1ccc(c(c1)F)C(=O)O
Complexity:
323
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: AE62466
ChemicalName: Methyl 5-bromo-2-(dibromomethyl)benzoate
CasNumber: 1265286-99-4
MolecularFormula: C9H7Br3O2
MolecularWeight: 386.86267999999995
MdlNumber: MFCD25121753
Smiles: COC(=O)c1cc(Br)ccc1C(Br)Br
Complexity: 208
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 3.9
CatalogNumber:
AE62466
ChemicalName:
Methyl 5-bromo-2-(dibromomethyl)benzoate
CasNumber:
1265286-99-4
MolecularFormula:
C9H7Br3O2
MolecularWeight:
386.86267999999995
MdlNumber:
MFCD25121753
Smiles:
COC(=O)c1cc(Br)ccc1C(Br)Br
Complexity:
208
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
3.9
CatalogNumber: AE62467
ChemicalName: 3-(4-Carboxy-3-fluorophenyl)-5-nitrobenzoic acid
CasNumber: 1261970-11-9
MolecularFormula: C14H8FNO6
MolecularWeight: 305.2148
MdlNumber: MFCD18321516
Smiles: [O-][N+](=O)c1cc(cc(c1)c1ccc(c(c1)F)C(=O)O)C(=O)O
Complexity: 465
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AE62467
ChemicalName:
3-(4-Carboxy-3-fluorophenyl)-5-nitrobenzoic acid
CasNumber:
1261970-11-9
MolecularFormula:
C14H8FNO6
MolecularWeight:
305.2148
MdlNumber:
MFCD18321516
Smiles:
[O-][N+](=O)c1cc(cc(c1)c1ccc(c(c1)F)C(=O)O)C(=O)O
Complexity:
465
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
2.5
CatalogNumber: AE62468
ChemicalName: Methyl 5-(dimethoxymethyl)pyridine-2-carboxylate
CasNumber: 125734-49-8
MolecularFormula: C10H13NO4
MolecularWeight: 211.2145
MdlNumber: MFCD22574961
Smiles: COC(=O)c1ccc(cn1)C(OC)OC
Complexity: 206
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 5
Xlogp3: 0.7
CatalogNumber:
AE62468
ChemicalName:
Methyl 5-(dimethoxymethyl)pyridine-2-carboxylate
CasNumber:
125734-49-8
MolecularFormula:
C10H13NO4
MolecularWeight:
211.2145
MdlNumber:
MFCD22574961
Smiles:
COC(=O)c1ccc(cn1)C(OC)OC
Complexity:
206
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
5
Xlogp3:
0.7