AE09597
1177198-30-9 | Trans-4-amino-1-benzyl-3-hydroxymethyl piperidine
Manufacturer: A2B Chem
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CatalogNumber
AE09597
ChemicalName
Trans-4-amino-1-benzyl-3-hydroxymethyl piperidine
CasNumber
1177198-30-9
MolecularFormula
C13H20N2O
MolecularWeight
220.3107
MdlNumber
MFCD03839871
Smiles
OC[C@@H]1CN(CC[C@H]1N)Cc1ccccc1
Complexity
204
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
1.1
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CatalogNumber: AE09597
ChemicalName: Trans-4-amino-1-benzyl-3-hydroxymethyl piperidine
CasNumber: 1177198-30-9
MolecularFormula: C13H20N2O
MolecularWeight: 220.3107
MdlNumber: MFCD03839871
Smiles: OC[C@@H]1CN(CC[C@H]1N)Cc1ccccc1
Complexity: 204
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.1
CatalogNumber:
AE09597
ChemicalName:
Trans-4-amino-1-benzyl-3-hydroxymethyl piperidine
CasNumber:
1177198-30-9
MolecularFormula:
C13H20N2O
MolecularWeight:
220.3107
MdlNumber:
MFCD03839871
Smiles:
OC[C@@H]1CN(CC[C@H]1N)Cc1ccccc1
Complexity:
204
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.1
CatalogNumber: __
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MolecularFormula: __
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Smiles: Fc1cccc(c1)C1CCNCC1
Complexity: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
Fc1cccc(c1)C1CCNCC1
Complexity:
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DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: NC(=O)[C@@H]1CCCN(C1)C(=O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
NC(=O)[C@@H]1CCCN(C1)C(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: BrCCCCC1CCNCC1.Br
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCCCC1CCNCC1.Br
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__