AE33960
13603-25-3 | 3-Benzylpiperidine
Manufacturer: A2B Chem
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CatalogNumber
AE33960
ChemicalName
3-Benzylpiperidine
CasNumber
13603-25-3
MolecularFormula
C12H17N
MolecularWeight
175.2701
MdlNumber
MFCD03426127
Smiles
C1CCC(CN1)Cc1ccccc1
Complexity
138
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
2.5
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CatalogNumber: AE33960
ChemicalName: 3-Benzylpiperidine
CasNumber: 13603-25-3
MolecularFormula: C12H17N
MolecularWeight: 175.2701
MdlNumber: MFCD03426127
Smiles: C1CCC(CN1)Cc1ccccc1
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.5
CatalogNumber:
AE33960
ChemicalName:
3-Benzylpiperidine
CasNumber:
13603-25-3
MolecularFormula:
C12H17N
MolecularWeight:
175.2701
MdlNumber:
MFCD03426127
Smiles:
C1CCC(CN1)Cc1ccccc1
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.5
CatalogNumber: AE33961
ChemicalName: (R)-2,2,2-Trifluoro-1-(3-(trifluoromethyl)phenyl)ethanamine
CasNumber: 1213841-80-5
MolecularFormula: C9H7F6N
MolecularWeight: 243.149
MdlNumber: MFCD07374574
Smiles: N[C@@H](C(F)(F)F)c1cccc(c1)C(F)(F)F
Complexity: 233
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 2.8
CatalogNumber:
AE33961
ChemicalName:
(R)-2,2,2-Trifluoro-1-(3-(trifluoromethyl)phenyl)ethanamine
CasNumber:
1213841-80-5
MolecularFormula:
C9H7F6N
MolecularWeight:
243.149
MdlNumber:
MFCD07374574
Smiles:
N[C@@H](C(F)(F)F)c1cccc(c1)C(F)(F)F
Complexity:
233
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1[C@H](C(F)(F)F)N)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1[C@H](C(F)(F)F)N)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1NCCc2c1cc(Br)cc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1NCCc2c1cc(Br)cc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__