AI00441
946126-94-9 | Methyl 2-fluoro-3-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AI00441
ChemicalName
Methyl 2-fluoro-3-nitrobenzoate
CasNumber
946126-94-9
MolecularFormula
C8H6FNO4
MolecularWeight
199.1359
MdlNumber
MFCD10566813
Smiles
COC(=O)c1cccc(c1F)[N+](=O)[O-]
Complexity
240
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AI00441
ChemicalName: Methyl 2-fluoro-3-nitrobenzoate
CasNumber: 946126-94-9
MolecularFormula: C8H6FNO4
MolecularWeight: 199.1359
MdlNumber: MFCD10566813
Smiles: COC(=O)c1cccc(c1F)[N+](=O)[O-]
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AI00441
ChemicalName:
Methyl 2-fluoro-3-nitrobenzoate
CasNumber:
946126-94-9
MolecularFormula:
C8H6FNO4
MolecularWeight:
199.1359
MdlNumber:
MFCD10566813
Smiles:
COC(=O)c1cccc(c1F)[N+](=O)[O-]
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: AI00442
ChemicalName: 2-Fluoro-4-methoxybenzonitrile
CasNumber: 94610-82-9
MolecularFormula: C8H6FNO
MolecularWeight: 151.1377432
MdlNumber: MFCD00509374
Smiles: COc1ccc(c(c1)F)C#N
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AI00442
ChemicalName:
2-Fluoro-4-methoxybenzonitrile
CasNumber:
94610-82-9
MolecularFormula:
C8H6FNO
MolecularWeight:
151.1377432
MdlNumber:
MFCD00509374
Smiles:
COc1ccc(c(c1)F)C#N
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.7
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Smiles: BrCC(=O)c1ccc(cc1)C(=O)CBr
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Smiles:
BrCC(=O)c1ccc(cc1)C(=O)CBr
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Smiles: O[C@H]1CCN(C1)c1ccc(cn1)Br
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HydrogenBondAcceptorCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
O[C@H]1CCN(C1)c1ccc(cn1)Br
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__