AI40190
1820604-19-0 | Benzyl 2-fluoro-6-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AI40190
ChemicalName
Benzyl 2-fluoro-6-nitrobenzoate
CasNumber
1820604-19-0
MolecularFormula
C14H10FNO4
MolecularWeight
275.2319
MdlNumber
MFCD28096640
Smiles
O=C(c1c(F)cccc1[N+](=O)[O-])OCc1ccccc1
Complexity
352
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
3.2
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CatalogNumber: AI40190
ChemicalName: Benzyl 2-fluoro-6-nitrobenzoate
CasNumber: 1820604-19-0
MolecularFormula: C14H10FNO4
MolecularWeight: 275.2319
MdlNumber: MFCD28096640
Smiles: O=C(c1c(F)cccc1[N+](=O)[O-])OCc1ccccc1
Complexity: 352
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 3.2
CatalogNumber:
AI40190
ChemicalName:
Benzyl 2-fluoro-6-nitrobenzoate
CasNumber:
1820604-19-0
MolecularFormula:
C14H10FNO4
MolecularWeight:
275.2319
MdlNumber:
MFCD28096640
Smiles:
O=C(c1c(F)cccc1[N+](=O)[O-])OCc1ccccc1
Complexity:
352
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
3.2
CatalogNumber: AI40191
ChemicalName: N-Acetyl 4-bromo-3-fluoro-6-methyl-2-nitroaniline
CasNumber: 1820604-24-7
MolecularFormula: C9H8BrFN2O3
MolecularWeight: 291.07382320000005
MdlNumber: MFCD25953889
Smiles: CC(=O)Nc1c(C)cc(c(c1[N+](=O)[O-])F)Br
Complexity: 297
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AI40191
ChemicalName:
N-Acetyl 4-bromo-3-fluoro-6-methyl-2-nitroaniline
CasNumber:
1820604-24-7
MolecularFormula:
C9H8BrFN2O3
MolecularWeight:
291.07382320000005
MdlNumber:
MFCD25953889
Smiles:
CC(=O)Nc1c(C)cc(c(c1[N+](=O)[O-])F)Br
Complexity:
297
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: AI40194
ChemicalName: 2-Chloro-4-fluoro-5-methanesulfonylaniline
CasNumber: 1820604-47-4
MolecularFormula: C7H7ClFNO2S
MolecularWeight: 223.6524
MdlNumber: MFCD28101656
Smiles: Fc1cc(Cl)c(cc1S(=O)(=O)C)N
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AI40194
ChemicalName:
2-Chloro-4-fluoro-5-methanesulfonylaniline
CasNumber:
1820604-47-4
MolecularFormula:
C7H7ClFNO2S
MolecularWeight:
223.6524
MdlNumber:
MFCD28101656
Smiles:
Fc1cc(Cl)c(cc1S(=O)(=O)C)N
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1.2
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Smiles: COC(=O)c1ccc(c(c1)C)c1ccc(cc1)C(=O)N(C)C
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Smiles:
COC(=O)c1ccc(c(c1)C)c1ccc(cc1)C(=O)N(C)C
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HeavyAtomCount:
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