AA29543
1249896-03-4 | N-Butyl-2,3-difluoro-6-nitroaniline
Manufacturer: A2B Chem
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CatalogNumber
AA29543
ChemicalName
N-Butyl-2,3-difluoro-6-nitroaniline
CasNumber
1249896-03-4
MolecularFormula
C10H12F2N2O2
MolecularWeight
230.2113
MdlNumber
MFCD16787132
Smiles
CCCCNc1c(ccc(c1F)F)[N+](=O)[O-]
Complexity
235
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3.7
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CatalogNumber: AA29543
ChemicalName: N-Butyl-2,3-difluoro-6-nitroaniline
CasNumber: 1249896-03-4
MolecularFormula: C10H12F2N2O2
MolecularWeight: 230.2113
MdlNumber: MFCD16787132
Smiles: CCCCNc1c(ccc(c1F)F)[N+](=O)[O-]
Complexity: 235
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.7
CatalogNumber:
AA29543
ChemicalName:
N-Butyl-2,3-difluoro-6-nitroaniline
CasNumber:
1249896-03-4
MolecularFormula:
C10H12F2N2O2
MolecularWeight:
230.2113
MdlNumber:
MFCD16787132
Smiles:
CCCCNc1c(ccc(c1F)F)[N+](=O)[O-]
Complexity:
235
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.7
CatalogNumber: AA29544
ChemicalName: N-Cyclopropyl-2,3-difluoro-6-nitroaniline
CasNumber: 1249882-57-2
MolecularFormula: C9H8F2N2O2
MolecularWeight: 214.1688
MdlNumber: MFCD16787126
Smiles: [O-][N+](=O)c1ccc(c(c1NC1CC1)F)F
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3
CatalogNumber:
AA29544
ChemicalName:
N-Cyclopropyl-2,3-difluoro-6-nitroaniline
CasNumber:
1249882-57-2
MolecularFormula:
C9H8F2N2O2
MolecularWeight:
214.1688
MdlNumber:
MFCD16787126
Smiles:
[O-][N+](=O)c1ccc(c(c1NC1CC1)F)F
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3
CatalogNumber: __
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Smiles: COC(=O)c1ncncc1Cl
Complexity: __
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Xlogp3: __
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Smiles:
COC(=O)c1ncncc1Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)c1ncc(o1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)c1ncc(o1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__