AE40443
13349-90-1 | 1-(2,2,2-Trifluoroethyl)piperazine
Manufacturer: A2B Chem
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CatalogNumber
AE40443
ChemicalName
1-(2,2,2-Trifluoroethyl)piperazine
CasNumber
13349-90-1
MolecularFormula
C6H11F3N2
MolecularWeight
168.16014959999998
MdlNumber
MFCD08444233
Smiles
FC(CN1CCNCC1)(F)F
Complexity
118
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.7
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CatalogNumber: AE40443
ChemicalName: 1-(2,2,2-Trifluoroethyl)piperazine
CasNumber: 13349-90-1
MolecularFormula: C6H11F3N2
MolecularWeight: 168.16014959999998
MdlNumber: MFCD08444233
Smiles: FC(CN1CCNCC1)(F)F
Complexity: 118
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AE40443
ChemicalName:
1-(2,2,2-Trifluoroethyl)piperazine
CasNumber:
13349-90-1
MolecularFormula:
C6H11F3N2
MolecularWeight:
168.16014959999998
MdlNumber:
MFCD08444233
Smiles:
FC(CN1CCNCC1)(F)F
Complexity:
118
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COc1cc(ccc1[n+]1nc(nn1c1cccc(c1)[N+](=O)[O-])c1ccccc1)c1ccc(c(c1)OC)[n+]1nc(nn1c1cccc(c1)[N+](=O)[O-])c1ccccc1.[Cl-].[Cl-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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Smiles:
COc1cc(ccc1[n+]1nc(nn1c1cccc(c1)[N+](=O)[O-])c1ccccc1)c1ccc(c(c1)OC)[n+]1nc(nn1c1cccc(c1)[N+](=O)[O-])c1ccccc1.[Cl-].[Cl-]
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: CC(c1cc(C(C)C)c(cc1C(C)C)Br)C
Complexity: __
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Smiles:
CC(c1cc(C(C)C)c(cc1C(C)C)Br)C
Complexity:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O=C(c1cccs1)/C=C/c1ccco1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1cccs1)/C=C/c1ccco1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__