AD49723
33974-27-5 | Phenyl(pyridin-4-yl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AD49723
ChemicalName
Phenyl(pyridin-4-yl)methanol
CasNumber
33974-27-5
MolecularFormula
C12H11NO
MolecularWeight
185.2218
MdlNumber
MFCD00277656
Smiles
OC(c1ccncc1)c1ccccc1
NscNumber
98955
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.7
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CatalogNumber: AD49723
ChemicalName: Phenyl(pyridin-4-yl)methanol
CasNumber: 33974-27-5
MolecularFormula: C12H11NO
MolecularWeight: 185.2218
MdlNumber: MFCD00277656
Smiles: OC(c1ccncc1)c1ccccc1
NscNumber: 98955
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.7
CatalogNumber:
AD49723
ChemicalName:
Phenyl(pyridin-4-yl)methanol
CasNumber:
33974-27-5
MolecularFormula:
C12H11NO
MolecularWeight:
185.2218
MdlNumber:
MFCD00277656
Smiles:
OC(c1ccncc1)c1ccccc1
NscNumber:
98955
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.7
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Smiles: O=C(ON1C(=O)CCC1=O)CNC(=O)C(F)(F)F
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Complexity: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
O=C(ON1C(=O)CCC1=O)CNC(=O)C(F)(F)F
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Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: Oc1nc(nc2c1CCCC2)N1CCCCC1
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Smiles:
Oc1nc(nc2c1CCCC2)N1CCCCC1
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
__
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Smiles: Clc1ccc2c(c1)c(=O)[nH]c(n2)S
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Clc1ccc2c(c1)c(=O)[nH]c(n2)S
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__