AH58391
79757-20-3 | Pyridin-4-yl-acetic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AH58391
ChemicalName
Pyridin-4-yl-acetic acid tert-butyl ester
CasNumber
79757-20-3
MolecularFormula
C11H15NO2
MolecularWeight
193.2423
MdlNumber
MFCD22565620
Smiles
O=C(Cc1ccncc1)OC(C)(C)C
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
1.3
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CatalogNumber: AH58391
ChemicalName: Pyridin-4-yl-acetic acid tert-butyl ester
CasNumber: 79757-20-3
MolecularFormula: C11H15NO2
MolecularWeight: 193.2423
MdlNumber: MFCD22565620
Smiles: O=C(Cc1ccncc1)OC(C)(C)C
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 1.3
CatalogNumber:
AH58391
ChemicalName:
Pyridin-4-yl-acetic acid tert-butyl ester
CasNumber:
79757-20-3
MolecularFormula:
C11H15NO2
MolecularWeight:
193.2423
MdlNumber:
MFCD22565620
Smiles:
O=C(Cc1ccncc1)OC(C)(C)C
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
1.3
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Smiles: CN(c1cnccn1)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CN(c1cnccn1)N
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
__
Xlogp3:
__
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Smiles: O/N=C(/c1ccncc1)N
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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__
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O/N=C(/c1ccncc1)N
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: N#CCc1ccc(c(c1)[N+](=O)[O-])N
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
N#CCc1ccc(c(c1)[N+](=O)[O-])N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__