AB68303
6304-16-1 | (4-Pyridyl)acetone
Manufacturer: A2B Chem
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CatalogNumber
AB68303
ChemicalName
(4-Pyridyl)acetone
CasNumber
6304-16-1
MolecularFormula
C8H9NO
MolecularWeight
135.1632
MdlNumber
MFCD00129043
Smiles
CC(=O)Cc1ccncc1
NscNumber
42613
Complexity
116
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
0.5
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CatalogNumber: AB68303
ChemicalName: (4-Pyridyl)acetone
CasNumber: 6304-16-1
MolecularFormula: C8H9NO
MolecularWeight: 135.1632
MdlNumber: MFCD00129043
Smiles: CC(=O)Cc1ccncc1
NscNumber: 42613
Complexity: 116
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AB68303
ChemicalName:
(4-Pyridyl)acetone
CasNumber:
6304-16-1
MolecularFormula:
C8H9NO
MolecularWeight:
135.1632
MdlNumber:
MFCD00129043
Smiles:
CC(=O)Cc1ccncc1
NscNumber:
42613
Complexity:
116
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: AB68304
ChemicalName: 4-Pyridylacetonitrile, HCl
CasNumber: 92333-25-0
MolecularFormula: C7H7ClN2
MolecularWeight: 154.59688000000003
MdlNumber: MFCD00012825
Smiles: N#CCc1ccncc1.Cl
NscNumber: __
Complexity: 116
Covalently-bondedUnitCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB68304
ChemicalName:
4-Pyridylacetonitrile, HCl
CasNumber:
92333-25-0
MolecularFormula:
C7H7ClN2
MolecularWeight:
154.59688000000003
MdlNumber:
MFCD00012825
Smiles:
N#CCc1ccncc1.Cl
NscNumber:
__
Complexity:
116
Covalently-bondedUnitCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCc1cc[n+](cc1)[O-]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCc1cc[n+](cc1)[O-]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)OB(OC1(C)C)c1ccnc2c1cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)OB(OC1(C)C)c1ccnc2c1cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__