AA01167
1001345-80-7 | 2-Fluoro-5-methoxy-4-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA01167
ChemicalName
2-Fluoro-5-methoxy-4-nitrobenzoic acid
CasNumber
1001345-80-7
MolecularFormula
C8H6FNO5
MolecularWeight
215.1353
MdlNumber
MFCD26395470
Smiles
COc1cc(C(=O)O)c(cc1[N+](=O)[O-])F
Complexity
266
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.3
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CatalogNumber: AA01167
ChemicalName: 2-Fluoro-5-methoxy-4-nitrobenzoic acid
CasNumber: 1001345-80-7
MolecularFormula: C8H6FNO5
MolecularWeight: 215.1353
MdlNumber: MFCD26395470
Smiles: COc1cc(C(=O)O)c(cc1[N+](=O)[O-])F
Complexity: 266
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AA01167
ChemicalName:
2-Fluoro-5-methoxy-4-nitrobenzoic acid
CasNumber:
1001345-80-7
MolecularFormula:
C8H6FNO5
MolecularWeight:
215.1353
MdlNumber:
MFCD26395470
Smiles:
COc1cc(C(=O)O)c(cc1[N+](=O)[O-])F
Complexity:
266
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1cc(ccc1Cl)NC(=O)c1cccc(c1)C(F)(F)F)Nc1cnc(nc1)Nc1cccnc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
O=C(c1cc(ccc1Cl)NC(=O)c1cccc(c1)C(F)(F)F)Nc1cnc(nc1)Nc1cccnc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: C1COc2c(O1)c(sc2)c1cnc2c(c1)ccc1c2ncc(c1)c1scc2c1OCCO2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C1COc2c(O1)c(sc2)c1cnc2c(c1)ccc1c2ncc(c1)c1scc2c1OCCO2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(n1)c(Br)c(cc2)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(n1)c(Br)c(cc2)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__