AG62504
495415-34-4 | 1-(tert-Butoxycarbonyl)-4-cyanopiperidine-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AG62504
ChemicalName
1-(tert-Butoxycarbonyl)-4-cyanopiperidine-4-carboxylic acid
CasNumber
495415-34-4
MolecularFormula
C12H18N2O4
MolecularWeight
254.2823
MdlNumber
MFCD12406601
Smiles
N#CC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O
Complexity
394
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.9
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CatalogNumber: AG62504
ChemicalName: 1-(tert-Butoxycarbonyl)-4-cyanopiperidine-4-carboxylic acid
CasNumber: 495415-34-4
MolecularFormula: C12H18N2O4
MolecularWeight: 254.2823
MdlNumber: MFCD12406601
Smiles: N#CC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O
Complexity: 394
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.9
CatalogNumber:
AG62504
ChemicalName:
1-(tert-Butoxycarbonyl)-4-cyanopiperidine-4-carboxylic acid
CasNumber:
495415-34-4
MolecularFormula:
C12H18N2O4
MolecularWeight:
254.2823
MdlNumber:
MFCD12406601
Smiles:
N#CC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O
Complexity:
394
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CC(=O)OC1CCN(CC1)C(=O)Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
CC(=O)OC1CCN(CC1)C(=O)Cl
Complexity:
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HeavyAtomCount:
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Smiles: O=CN1CCCC(C1)C(=O)O
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Smiles:
O=CN1CCCC(C1)C(=O)O
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Cc1sc(nc1CC(=O)OC)Br
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1sc(nc1CC(=O)OC)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__