AA57074
1381944-46-2 | Methyl 2-fluoro-3-(4-fluoro-3-methoxyphenyl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AA57074
ChemicalName
Methyl 2-fluoro-3-(4-fluoro-3-methoxyphenyl)benzoate
CasNumber
1381944-46-2
MolecularFormula
C15H12F2O3
MolecularWeight
278.2508
MdlNumber
MFCD22375058
Smiles
COC(=O)c1cccc(c1F)c1ccc(c(c1)OC)F
Complexity
337
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
3.6
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CatalogNumber: AA57074
ChemicalName: Methyl 2-fluoro-3-(4-fluoro-3-methoxyphenyl)benzoate
CasNumber: 1381944-46-2
MolecularFormula: C15H12F2O3
MolecularWeight: 278.2508
MdlNumber: MFCD22375058
Smiles: COC(=O)c1cccc(c1F)c1ccc(c(c1)OC)F
Complexity: 337
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 3.6
CatalogNumber:
AA57074
ChemicalName:
Methyl 2-fluoro-3-(4-fluoro-3-methoxyphenyl)benzoate
CasNumber:
1381944-46-2
MolecularFormula:
C15H12F2O3
MolecularWeight:
278.2508
MdlNumber:
MFCD22375058
Smiles:
COC(=O)c1cccc(c1F)c1ccc(c(c1)OC)F
Complexity:
337
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cc2nnn(c2cc1F)C1CCCC1
Complexity: 260
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cc2nnn(c2cc1F)C1CCCC1
Complexity:
260
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: AA57076
ChemicalName: 4-Bromo-2,3-difluoro-N-methyl-6-nitroaniline
CasNumber: 1381944-44-0
MolecularFormula: C7H5BrF2N2O2
MolecularWeight: 267.0276
MdlNumber: MFCD22375000
Smiles: CNc1c(cc(c(c1F)F)Br)[N+](=O)[O-]
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 3.2
CatalogNumber:
AA57076
ChemicalName:
4-Bromo-2,3-difluoro-N-methyl-6-nitroaniline
CasNumber:
1381944-44-0
MolecularFormula:
C7H5BrF2N2O2
MolecularWeight:
267.0276
MdlNumber:
MFCD22375000
Smiles:
CNc1c(cc(c(c1F)F)Br)[N+](=O)[O-]
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
3.2
CatalogNumber: AA57077
ChemicalName: Methyl 4-[(ethoxycarbonylmethyl)amino]-3-nitrobenzoate
CasNumber: 1381944-43-9
MolecularFormula: C12H14N2O6
MolecularWeight: 282.2494
MdlNumber: MFCD22375026
Smiles: CCOC(=O)CNc1ccc(cc1[N+](=O)[O-])C(=O)OC
Complexity: 367
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
RotatableBondCount: 7
Xlogp3: 2.4
CatalogNumber:
AA57077
ChemicalName:
Methyl 4-[(ethoxycarbonylmethyl)amino]-3-nitrobenzoate
CasNumber:
1381944-43-9
MolecularFormula:
C12H14N2O6
MolecularWeight:
282.2494
MdlNumber:
MFCD22375026
Smiles:
CCOC(=O)CNc1ccc(cc1[N+](=O)[O-])C(=O)OC
Complexity:
367
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
RotatableBondCount:
7
Xlogp3:
2.4