AE27689
1108684-03-2 | (1S)-1-(4-Bromophenyl)propan-1-amine
Manufacturer: A2B Chem
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CatalogNumber
AE27689
ChemicalName
(1S)-1-(4-Bromophenyl)propan-1-amine
CasNumber
1108684-03-2
MolecularFormula
C9H13BrClN
MolecularWeight
250.5632
MdlNumber
MFCD06761890
Smiles
CC[C@@H](c1ccc(cc1)Br)N.Cl
Complexity
108
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AE27689
ChemicalName: (1S)-1-(4-Bromophenyl)propan-1-amine
CasNumber: 1108684-03-2
MolecularFormula: C9H13BrClN
MolecularWeight: 250.5632
MdlNumber: MFCD06761890
Smiles: CC[C@@H](c1ccc(cc1)Br)N.Cl
Complexity: 108
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AE27689
ChemicalName:
(1S)-1-(4-Bromophenyl)propan-1-amine
CasNumber:
1108684-03-2
MolecularFormula:
C9H13BrClN
MolecularWeight:
250.5632
MdlNumber:
MFCD06761890
Smiles:
CC[C@@H](c1ccc(cc1)Br)N.Cl
Complexity:
108
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
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Smiles: N[C@H]1CCc2c1cccc2C
Complexity: __
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HeavyAtomCount: __
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Smiles:
N[C@H]1CCc2c1cccc2C
Complexity:
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DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: N[C@H]1CCc2c1c(F)ccc2
Complexity: __
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@H]1CCc2c1c(F)ccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)[C@@H](N)CCC2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)[C@@H](N)CCC2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__