AI53093
58547-68-5 | 4-[(Piperidin-1-yl)carbonyl]phenol
Manufacturer: A2B Chem
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CatalogNumber
AI53093
ChemicalName
4-[(Piperidin-1-yl)carbonyl]phenol
CasNumber
58547-68-5
MolecularFormula
C12H15NO2
MolecularWeight
205.253
MdlNumber
MFCD01017284
Smiles
O=C(c1ccc(cc1)O)N1CCCCC1
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.9
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CatalogNumber: AI53093
ChemicalName: 4-[(Piperidin-1-yl)carbonyl]phenol
CasNumber: 58547-68-5
MolecularFormula: C12H15NO2
MolecularWeight: 205.253
MdlNumber: MFCD01017284
Smiles: O=C(c1ccc(cc1)O)N1CCCCC1
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AI53093
ChemicalName:
4-[(Piperidin-1-yl)carbonyl]phenol
CasNumber:
58547-68-5
MolecularFormula:
C12H15NO2
MolecularWeight:
205.253
MdlNumber:
MFCD01017284
Smiles:
O=C(c1ccc(cc1)O)N1CCCCC1
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN(C(=O)c1ccccc1)c1ccc(c(c1)C)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN(C(=O)c1ccccc1)c1ccc(c(c1)C)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1cc(cc(c1O)Cl)S(=O)(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1cc(cc(c1O)Cl)S(=O)(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI53096
ChemicalName: 4-tert-Butyl-1-chloro-2-nitrobenzene
CasNumber: 58574-05-3
MolecularFormula: C10H12ClNO2
MolecularWeight: 213.6608
MdlNumber: MFCD07368382
Smiles: [O-][N+](=O)c1cc(ccc1Cl)C(C)(C)C
Complexity: 219
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 4.1
CatalogNumber:
AI53096
ChemicalName:
4-tert-Butyl-1-chloro-2-nitrobenzene
CasNumber:
58574-05-3
MolecularFormula:
C10H12ClNO2
MolecularWeight:
213.6608
MdlNumber:
MFCD07368382
Smiles:
[O-][N+](=O)c1cc(ccc1Cl)C(C)(C)C
Complexity:
219
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
4.1