AI36504
1480151-85-6 | tert-Butyl 2-(4-fluoro-2-methylphenyl)-4-oxopiperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI36504
ChemicalName
tert-Butyl 2-(4-fluoro-2-methylphenyl)-4-oxopiperidine-1-carboxylate
CasNumber
1480151-85-6
MolecularFormula
C17H22FNO3
MolecularWeight
307.3598831999999
MdlNumber
MFCD24537210
Smiles
O=C1CCN(C(C1)c1ccc(cc1C)F)C(=O)OC(C)(C)C
Complexity
432
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
2.6
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CatalogNumber: AI36504
ChemicalName: tert-Butyl 2-(4-fluoro-2-methylphenyl)-4-oxopiperidine-1-carboxylate
CasNumber: 1480151-85-6
MolecularFormula: C17H22FNO3
MolecularWeight: 307.3598831999999
MdlNumber: MFCD24537210
Smiles: O=C1CCN(C(C1)c1ccc(cc1C)F)C(=O)OC(C)(C)C
Complexity: 432
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.6
CatalogNumber:
AI36504
ChemicalName:
tert-Butyl 2-(4-fluoro-2-methylphenyl)-4-oxopiperidine-1-carboxylate
CasNumber:
1480151-85-6
MolecularFormula:
C17H22FNO3
MolecularWeight:
307.3598831999999
MdlNumber:
MFCD24537210
Smiles:
O=C1CCN(C(C1)c1ccc(cc1C)F)C(=O)OC(C)(C)C
Complexity:
432
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.6
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Smiles: CC(C)N1C(=C2CCCC2=N1)N
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CC(C)N1C(=C2CCCC2=N1)N
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Smiles: CCCS(=O)(=O)c1ccc(cc1)O
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CCCS(=O)(=O)c1ccc(cc1)O
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Smiles: COc1ccc(c(c1C)C)Cl
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Smiles:
COc1ccc(c(c1C)C)Cl
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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