AD13625
654-76-2 | 1-Methoxy-4-nitro-2-(trifluoromethyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AD13625
ChemicalName
1-Methoxy-4-nitro-2-(trifluoromethyl)benzene
CasNumber
654-76-2
MolecularFormula
C8H6F3NO3
MolecularWeight
221.1333
MdlNumber
MFCD00007328
Smiles
COc1ccc(cc1C(F)(F)F)[N+](=O)[O-]
NscNumber
88331
Complexity
238
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
RotatableBondCount
1
Xlogp3
2.6
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CatalogNumber: AD13625
ChemicalName: 1-Methoxy-4-nitro-2-(trifluoromethyl)benzene
CasNumber: 654-76-2
MolecularFormula: C8H6F3NO3
MolecularWeight: 221.1333
MdlNumber: MFCD00007328
Smiles: COc1ccc(cc1C(F)(F)F)[N+](=O)[O-]
NscNumber: 88331
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AD13625
ChemicalName:
1-Methoxy-4-nitro-2-(trifluoromethyl)benzene
CasNumber:
654-76-2
MolecularFormula:
C8H6F3NO3
MolecularWeight:
221.1333
MdlNumber:
MFCD00007328
Smiles:
COc1ccc(cc1C(F)(F)F)[N+](=O)[O-]
NscNumber:
88331
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
Xlogp3:
2.6
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Smiles: CSC(=C1C(=O)c2c(C1=O)cccc2)SC
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Complexity: __
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Smiles:
CSC(=C1C(=O)c2c(C1=O)cccc2)SC
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Smiles: CN(C(=O)c1c(O)c(N)ccc1C(F)(F)F)C
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CN(C(=O)c1c(O)c(N)ccc1C(F)(F)F)C
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Smiles: Fc1ccc(cc1)CCC(=O)c1ccc(cc1)C(F)(F)F
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Fc1ccc(cc1)CCC(=O)c1ccc(cc1)C(F)(F)F
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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