AI56345
78068-85-6 | 3-Chloro-4-fluorobenzotrifluoride
Manufacturer: A2B Chem
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CatalogNumber
AI56345
ChemicalName
3-Chloro-4-fluorobenzotrifluoride
CasNumber
78068-85-6
MolecularFormula
C7H3ClF4
MolecularWeight
198.5453
MdlNumber
MFCD00042207
Smiles
C1=CC(=C(C=C1C(F)(F)F)Cl)F
Complexity
156
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
Xlogp3
3.5
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CatalogNumber: AI56345
ChemicalName: 3-Chloro-4-fluorobenzotrifluoride
CasNumber: 78068-85-6
MolecularFormula: C7H3ClF4
MolecularWeight: 198.5453
MdlNumber: MFCD00042207
Smiles: C1=CC(=C(C=C1C(F)(F)F)Cl)F
Complexity: 156
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
Xlogp3: 3.5
CatalogNumber:
AI56345
ChemicalName:
3-Chloro-4-fluorobenzotrifluoride
CasNumber:
78068-85-6
MolecularFormula:
C7H3ClF4
MolecularWeight:
198.5453
MdlNumber:
MFCD00042207
Smiles:
C1=CC(=C(C=C1C(F)(F)F)Cl)F
Complexity:
156
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
Xlogp3:
3.5
CatalogNumber: __
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MolecularFormula: __
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Smiles: N1CCN(CC1)c1ncccn1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
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Smiles:
N1CCN(CC1)c1ncccn1.Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
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Smiles: O=C(N1CCN(CC1)c1ncccn1)OC(C)(C)C
Complexity: __
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Smiles:
O=C(N1CCN(CC1)c1ncccn1)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
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Smiles: Fc1ccc(c(c1)C)[C@H]1CNCCN1
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Smiles:
Fc1ccc(c(c1)C)[C@H]1CNCCN1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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Xlogp3:
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