AB58540
42346-68-9 | 1-Methyl-5-oxo-pyrrolidine-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB58540
ChemicalName
1-Methyl-5-oxo-pyrrolidine-3-carboxylic acid
CasNumber
42346-68-9
MolecularFormula
C6H9NO3
MolecularWeight
143.1406
MdlNumber
MFCD00014102
Smiles
OC(=O)C1CC(=O)N(C1)C
Complexity
178
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
-1
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CatalogNumber: AB58540
ChemicalName: 1-Methyl-5-oxo-pyrrolidine-3-carboxylic acid
CasNumber: 42346-68-9
MolecularFormula: C6H9NO3
MolecularWeight: 143.1406
MdlNumber: MFCD00014102
Smiles: OC(=O)C1CC(=O)N(C1)C
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: -1
CatalogNumber:
AB58540
ChemicalName:
1-Methyl-5-oxo-pyrrolidine-3-carboxylic acid
CasNumber:
42346-68-9
MolecularFormula:
C6H9NO3
MolecularWeight:
143.1406
MdlNumber:
MFCD00014102
Smiles:
OC(=O)C1CC(=O)N(C1)C
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
-1
CatalogNumber: AB58541
ChemicalName: 1-Methyl-2-phenylindole
CasNumber: 3558-24-5
MolecularFormula: C15H13N
MolecularWeight: 207.27042000000003
MdlNumber: MFCD00022892
Smiles: Cn1c(cc2c1cccc2)c1ccccc1
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 4.1
CatalogNumber:
AB58541
ChemicalName:
1-Methyl-2-phenylindole
CasNumber:
3558-24-5
MolecularFormula:
C15H13N
MolecularWeight:
207.27042000000003
MdlNumber:
MFCD00022892
Smiles:
Cn1c(cc2c1cccc2)c1ccccc1
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
4.1
CatalogNumber: AB58542
ChemicalName: 1-Methyl-2-pyrrolidine ethanol
CasNumber: 67004-64-2
MolecularFormula: C7H15NO
MolecularWeight: 129.2001
MdlNumber: MFCD00003174
Smiles: OCCC1CCCN1C
Complexity: 85
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.5
CatalogNumber:
AB58542
ChemicalName:
1-Methyl-2-pyrrolidine ethanol
CasNumber:
67004-64-2
MolecularFormula:
C7H15NO
MolecularWeight:
129.2001
MdlNumber:
MFCD00003174
Smiles:
OCCC1CCCN1C
Complexity:
85
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1N(C([2H])([2H])[2H])C(C(C1([2H])[2H])([2H])[2H])([2H])[2H]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1N(C([2H])([2H])[2H])C(C(C1([2H])[2H])([2H])[2H])([2H])[2H]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__