AB45436
4775-98-8 | 6-Methylpiperidin-2-one
Manufacturer: A2B Chem
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CatalogNumber
AB45436
ChemicalName
6-Methylpiperidin-2-one
CasNumber
4775-98-8
MolecularFormula
C6H11NO
MolecularWeight
113.1576
MdlNumber
MFCD00127922
Smiles
CC1CCCC(=O)N1
Complexity
101
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
0.4
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CatalogNumber: AB45436
ChemicalName: 6-Methylpiperidin-2-one
CasNumber: 4775-98-8
MolecularFormula: C6H11NO
MolecularWeight: 113.1576
MdlNumber: MFCD00127922
Smiles: CC1CCCC(=O)N1
Complexity: 101
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.4
CatalogNumber:
AB45436
ChemicalName:
6-Methylpiperidin-2-one
CasNumber:
4775-98-8
MolecularFormula:
C6H11NO
MolecularWeight:
113.1576
MdlNumber:
MFCD00127922
Smiles:
CC1CCCC(=O)N1
Complexity:
101
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.4
CatalogNumber: AB45437
ChemicalName: 6-Methylpicolinic acid
CasNumber: 934-60-1
MolecularFormula: C7H7NO2
MolecularWeight: 137.136
MdlNumber: MFCD00023481
Smiles: Cc1cccc(n1)C(=O)O
Complexity: 136
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 1.1
CatalogNumber:
AB45437
ChemicalName:
6-Methylpicolinic acid
CasNumber:
934-60-1
MolecularFormula:
C7H7NO2
MolecularWeight:
137.136
MdlNumber:
MFCD00023481
Smiles:
Cc1cccc(n1)C(=O)O
Complexity:
136
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCC(=NN1)C(=O)O
Complexity: 209
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: -1.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCC(=NN1)C(=O)O
Complexity:
209
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
-1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)Cc1ccc2c(c1)cccn2
Complexity: 217
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)Cc1ccc2c(c1)cccn2
Complexity:
217
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.7