AE98309
154598-53-5 | 2'-Amino-5'-chloro-2,2,2-trifluoroacetophenone
Manufacturer: A2B Chem
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CatalogNumber
AE98309
ChemicalName
2'-Amino-5'-chloro-2,2,2-trifluoroacetophenone
CasNumber
154598-53-5
MolecularFormula
C8H5ClF3NO
MolecularWeight
223.5796
MdlNumber
MFCD08458216
Smiles
O=C(C(F)(F)F)c1cc(Cl)ccc1N
Complexity
231
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.2
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CatalogNumber: AE98309
ChemicalName: 2'-Amino-5'-chloro-2,2,2-trifluoroacetophenone
CasNumber: 154598-53-5
MolecularFormula: C8H5ClF3NO
MolecularWeight: 223.5796
MdlNumber: MFCD08458216
Smiles: O=C(C(F)(F)F)c1cc(Cl)ccc1N
Complexity: 231
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.2
CatalogNumber:
AE98309
ChemicalName:
2'-Amino-5'-chloro-2,2,2-trifluoroacetophenone
CasNumber:
154598-53-5
MolecularFormula:
C8H5ClF3NO
MolecularWeight:
223.5796
MdlNumber:
MFCD08458216
Smiles:
O=C(C(F)(F)F)c1cc(Cl)ccc1N
Complexity:
231
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.2
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Smiles: COc1ccc(cc1)CNc1ccc(cc1[C@](C(F)(F)F)(C#CC1CC1)O)Cl
Complexity: __
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Smiles:
COc1ccc(cc1)CNc1ccc(cc1[C@](C(F)(F)F)(C#CC1CC1)O)Cl
Complexity:
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RotatableBondCount:
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Smiles: C1=CC=C2C3=C4C(=CC2=C1)OC5=CC=CC=C5[N+]4=CC=C3
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Smiles:
C1=CC=C2C3=C4C(=CC2=C1)OC5=CC=CC=C5[N+]4=CC=C3
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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MolecularFormula: __
MolecularWeight: __
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Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
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Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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