AE62137
1249752-31-5 | 2-Pentanoyl-3-picoline
Manufacturer: A2B Chem
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CatalogNumber
AE62137
ChemicalName
2-Pentanoyl-3-picoline
CasNumber
1249752-31-5
MolecularFormula
C11H15NO
MolecularWeight
177.2429
MdlNumber
MFCD16820170
Smiles
CCCCC(=O)c1ncccc1C
Complexity
168
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
4
Xlogp3
2.6
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CatalogNumber: AE62137
ChemicalName: 2-Pentanoyl-3-picoline
CasNumber: 1249752-31-5
MolecularFormula: C11H15NO
MolecularWeight: 177.2429
MdlNumber: MFCD16820170
Smiles: CCCCC(=O)c1ncccc1C
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 2.6
CatalogNumber:
AE62137
ChemicalName:
2-Pentanoyl-3-picoline
CasNumber:
1249752-31-5
MolecularFormula:
C11H15NO
MolecularWeight:
177.2429
MdlNumber:
MFCD16820170
Smiles:
CCCCC(=O)c1ncccc1C
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
2.6
CatalogNumber: AE62138
ChemicalName: 3-(3-Methylphenyl)pyridine-2-carbonitrile
CasNumber: 1415819-78-1
MolecularFormula: C13H10N2
MolecularWeight: 194.2319
MdlNumber: MFCD22586706
Smiles: N#Cc1ncccc1c1cccc(c1)C
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AE62138
ChemicalName:
3-(3-Methylphenyl)pyridine-2-carbonitrile
CasNumber:
1415819-78-1
MolecularFormula:
C13H10N2
MolecularWeight:
194.2319
MdlNumber:
MFCD22586706
Smiles:
N#Cc1ncccc1c1cccc(c1)C
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1nnccc1N.Cl
Complexity: 88.3
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COc1nnccc1N.Cl
Complexity:
88.3
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N1CCC(CC1)Oc1ccccn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N1CCC(CC1)Oc1ccccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__