AC70884
951247-75-9 | (S)-1-(4-(Trifluoromethoxy)phenyl)ethanamine
Manufacturer: A2B Chem
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CatalogNumber
AC70884
ChemicalName
(S)-1-(4-(Trifluoromethoxy)phenyl)ethanamine
CasNumber
951247-75-9
MolecularFormula
C9H10F3NO
MolecularWeight
205.17700959999993
MdlNumber
MFCD08057413
Smiles
C[C@@H](c1ccc(cc1)OC(F)(F)F)N
Complexity
175
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AC70884
ChemicalName: (S)-1-(4-(Trifluoromethoxy)phenyl)ethanamine
CasNumber: 951247-75-9
MolecularFormula: C9H10F3NO
MolecularWeight: 205.17700959999993
MdlNumber: MFCD08057413
Smiles: C[C@@H](c1ccc(cc1)OC(F)(F)F)N
Complexity: 175
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AC70884
ChemicalName:
(S)-1-(4-(Trifluoromethoxy)phenyl)ethanamine
CasNumber:
951247-75-9
MolecularFormula:
C9H10F3NO
MolecularWeight:
205.17700959999993
MdlNumber:
MFCD08057413
Smiles:
C[C@@H](c1ccc(cc1)OC(F)(F)F)N
Complexity:
175
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
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Smiles: COC(=O)c1nc2-c(c[nH]1)ncn2
Complexity: __
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RotatableBondCount: __
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Smiles:
COC(=O)c1nc2-c(c[nH]1)ncn2
Complexity:
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Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: CC(=O)c1ncc([nH]1)C(C(C(CO)O)O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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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:
CC(=O)c1ncc([nH]1)C(C(C(CO)O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCn1nnc(n1)N
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCn1nnc(n1)N
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__