AH94218
910123-09-0 | Methyl 3,5-difluoro-2-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AH94218
ChemicalName
Methyl 3,5-difluoro-2-nitrobenzoate
CasNumber
910123-09-0
MolecularFormula
C8H5F2NO4
MolecularWeight
217.12640639999998
MdlNumber
MFCD14698035
Smiles
COC(=O)c1cc(F)cc(c1[N+](=O)[O-])F
Complexity
268
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AH94218
ChemicalName: Methyl 3,5-difluoro-2-nitrobenzoate
CasNumber: 910123-09-0
MolecularFormula: C8H5F2NO4
MolecularWeight: 217.12640639999998
MdlNumber: MFCD14698035
Smiles: COC(=O)c1cc(F)cc(c1[N+](=O)[O-])F
Complexity: 268
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AH94218
ChemicalName:
Methyl 3,5-difluoro-2-nitrobenzoate
CasNumber:
910123-09-0
MolecularFormula:
C8H5F2NO4
MolecularWeight:
217.12640639999998
MdlNumber:
MFCD14698035
Smiles:
COC(=O)c1cc(F)cc(c1[N+](=O)[O-])F
Complexity:
268
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: AH94219
ChemicalName: Methyl 3-bromo-5-(bromomethyl)benzoate
CasNumber: 877624-40-3
MolecularFormula: C9H8Br2O2
MolecularWeight: 307.9666
MdlNumber: MFCD11044991
Smiles: COC(=O)c1cc(CBr)cc(c1)Br
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AH94219
ChemicalName:
Methyl 3-bromo-5-(bromomethyl)benzoate
CasNumber:
877624-40-3
MolecularFormula:
C9H8Br2O2
MolecularWeight:
307.9666
MdlNumber:
MFCD11044991
Smiles:
COC(=O)c1cc(CBr)cc(c1)Br
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: AH94220
ChemicalName: Methyl 3-fluoro-4-(hydroxymethyl)benzoate
CasNumber: 937636-18-5
MolecularFormula: C9H9FO3
MolecularWeight: 184.16436319999994
MdlNumber: MFCD09836511
Smiles: COC(=O)c1ccc(c(c1)F)CO
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AH94220
ChemicalName:
Methyl 3-fluoro-4-(hydroxymethyl)benzoate
CasNumber:
937636-18-5
MolecularFormula:
C9H9FO3
MolecularWeight:
184.16436319999994
MdlNumber:
MFCD09836511
Smiles:
COC(=O)c1ccc(c(c1)F)CO
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1
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Smiles: COC(=O)c1nn(c(c1)N)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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MolecularFormula:
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Smiles:
COC(=O)c1nn(c(c1)N)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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