AX12572
918321-24-1 | Methyl 2,3,4-trifluoro-5-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AX12572
ChemicalName
Methyl 2,3,4-trifluoro-5-nitrobenzoate
CasNumber
918321-24-1
MolecularFormula
C8H4F3NO4
MolecularWeight
235.1169
MdlNumber
MFCD13248633
Smiles
COC(=O)c1cc([N+](=O)[O-])c(c(c1F)F)F
Complexity
296
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
7
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AX12572
ChemicalName: Methyl 2,3,4-trifluoro-5-nitrobenzoate
CasNumber: 918321-24-1
MolecularFormula: C8H4F3NO4
MolecularWeight: 235.1169
MdlNumber: MFCD13248633
Smiles: COC(=O)c1cc([N+](=O)[O-])c(c(c1F)F)F
Complexity: 296
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AX12572
ChemicalName:
Methyl 2,3,4-trifluoro-5-nitrobenzoate
CasNumber:
918321-24-1
MolecularFormula:
C8H4F3NO4
MolecularWeight:
235.1169
MdlNumber:
MFCD13248633
Smiles:
COC(=O)c1cc([N+](=O)[O-])c(c(c1F)F)F
Complexity:
296
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(nc2c1cccc2F)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
OC(=O)c1cc(nc2c1cccc2F)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: O=C(n1cccc1C(F)(F)F)OC(C)(C)C
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
O=C(n1cccc1C(F)(F)F)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Nc1[nH]nc2c1c1nc3ccccc3cc1cn2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1[nH]nc2c1c1nc3ccccc3cc1cn2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__