AB43243
10315-07-8 | 1-Benzylpiperidine-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB43243
ChemicalName
1-Benzylpiperidine-4-carboxylic acid
CasNumber
10315-07-8
MolecularFormula
C13H17NO2
MolecularWeight
219.2796
MdlNumber
MFCD03371463
Smiles
OC(=O)C1CCN(CC1)Cc1ccccc1
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
-0.5
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CatalogNumber: AB43243
ChemicalName: 1-Benzylpiperidine-4-carboxylic acid
CasNumber: 10315-07-8
MolecularFormula: C13H17NO2
MolecularWeight: 219.2796
MdlNumber: MFCD03371463
Smiles: OC(=O)C1CCN(CC1)Cc1ccccc1
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: -0.5
CatalogNumber:
AB43243
ChemicalName:
1-Benzylpiperidine-4-carboxylic acid
CasNumber:
10315-07-8
MolecularFormula:
C13H17NO2
MolecularWeight:
219.2796
MdlNumber:
MFCD03371463
Smiles:
OC(=O)C1CCN(CC1)Cc1ccccc1
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
-0.5
CatalogNumber: AB43244
ChemicalName: Boc-isoguvacine
CasNumber: 70684-84-3
MolecularFormula: C11H17NO4
MolecularWeight: 227.257
MdlNumber: MFCD02682417
Smiles: O=C(N1CCC(=CC1)C(=O)O)OC(C)(C)C
Complexity: 327
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AB43244
ChemicalName:
Boc-isoguvacine
CasNumber:
70684-84-3
MolecularFormula:
C11H17NO4
MolecularWeight:
227.257
MdlNumber:
MFCD02682417
Smiles:
O=C(N1CCC(=CC1)C(=O)O)OC(C)(C)C
Complexity:
327
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1
CatalogNumber: AB43245
ChemicalName: N-Boc-1,4-cyclohexanediamine
CasNumber: 195314-59-1
MolecularFormula: C11H22N2O2
MolecularWeight: 214.3046
MdlNumber: MFCD01076211
Smiles: NC1CCC(CC1)NC(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB43245
ChemicalName:
N-Boc-1,4-cyclohexanediamine
CasNumber:
195314-59-1
MolecularFormula:
C11H22N2O2
MolecularWeight:
214.3046
MdlNumber:
MFCD01076211
Smiles:
NC1CCC(CC1)NC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCN(C(C1)(C)C)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCN(C(C1)(C)C)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__