AD94113
84832-01-9 | Methyl 2,6-difluoro-3-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AD94113
ChemicalName
Methyl 2,6-difluoro-3-nitrobenzoate
CasNumber
84832-01-9
MolecularFormula
C8H5F2NO4
MolecularWeight
217.1264
MdlNumber
MFCD07368850
Smiles
COC(=O)c1c(F)ccc(c1F)[N+](=O)[O-]
Complexity
268
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AD94113
ChemicalName: Methyl 2,6-difluoro-3-nitrobenzoate
CasNumber: 84832-01-9
MolecularFormula: C8H5F2NO4
MolecularWeight: 217.1264
MdlNumber: MFCD07368850
Smiles: COC(=O)c1c(F)ccc(c1F)[N+](=O)[O-]
Complexity: 268
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AD94113
ChemicalName:
Methyl 2,6-difluoro-3-nitrobenzoate
CasNumber:
84832-01-9
MolecularFormula:
C8H5F2NO4
MolecularWeight:
217.1264
MdlNumber:
MFCD07368850
Smiles:
COC(=O)c1c(F)ccc(c1F)[N+](=O)[O-]
Complexity:
268
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: AD94114
ChemicalName: 5-Amino-2-fluorobenzyl alcohol
CasNumber: 84832-00-8
MolecularFormula: C7H8FNO
MolecularWeight: 141.1429
MdlNumber: MFCD03094257
Smiles: OCc1cc(N)ccc1F
Complexity: 110
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 0.5
CatalogNumber:
AD94114
ChemicalName:
5-Amino-2-fluorobenzyl alcohol
CasNumber:
84832-00-8
MolecularFormula:
C7H8FNO
MolecularWeight:
141.1429
MdlNumber:
MFCD03094257
Smiles:
OCc1cc(N)ccc1F
Complexity:
110
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
0.5
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Smiles: OC(=O)c1ccnc(c1I)Br
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Smiles:
OC(=O)c1ccnc(c1I)Br
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: OC(=O)c1nc([nH]c(=O)c1Cl)C1CC1
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)c1nc([nH]c(=O)c1Cl)C1CC1
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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