AB41970
30932-84-4 | 1-Methyl-2-oxopyrrolidine-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB41970
ChemicalName
1-Methyl-2-oxopyrrolidine-3-carboxylic acid
CasNumber
30932-84-4
MolecularFormula
C6H9NO3
MolecularWeight
143.1406
MdlNumber
MFCD19228580
Smiles
CN1CCC(C1=O)C(=O)O
Complexity
178
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
0.1
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CatalogNumber: AB41970
ChemicalName: 1-Methyl-2-oxopyrrolidine-3-carboxylic acid
CasNumber: 30932-84-4
MolecularFormula: C6H9NO3
MolecularWeight: 143.1406
MdlNumber: MFCD19228580
Smiles: CN1CCC(C1=O)C(=O)O
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.1
CatalogNumber:
AB41970
ChemicalName:
1-Methyl-2-oxopyrrolidine-3-carboxylic acid
CasNumber:
30932-84-4
MolecularFormula:
C6H9NO3
MolecularWeight:
143.1406
MdlNumber:
MFCD19228580
Smiles:
CN1CCC(C1=O)C(=O)O
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1N(C)CCCC1=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1N(C)CCCC1=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CC1CC1(c1ccccc1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CC1CC1(c1ccccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB41973
ChemicalName: (2Z)-3-ethyl-2-{2-[(2Z)-3-ethyl-6-sulfo-1,3-benzothiazol-2-ylidene]hydrazin-1-ylidene}-1,3-benzothiazole-6-sulfonic acid diamine
CasNumber: 30931-67-0
MolecularFormula: C18H24N6O6S4
MolecularWeight: 548.6798
MdlNumber: MFCD00010404
Smiles: CCn1c(=NN=c2sc3c(n2CC)ccc(c3)S(=O)(=O)[O-])sc2c1ccc(c2)S(=O)(=O)[O-].[NH4+].[NH4+]
Complexity: 910
Covalently-bondedUnitCount: 3
HeavyAtomCount: 34
HydrogenBondAcceptorCount: 12
HydrogenBondDonorCount: 4
RotatableBondCount: 5
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB41973
ChemicalName:
(2Z)-3-ethyl-2-{2-[(2Z)-3-ethyl-6-sulfo-1,3-benzothiazol-2-ylidene]hydrazin-1-ylidene}-1,3-benzothiazole-6-sulfonic acid diamine
CasNumber:
30931-67-0
MolecularFormula:
C18H24N6O6S4
MolecularWeight:
548.6798
MdlNumber:
MFCD00010404
Smiles:
CCn1c(=NN=c2sc3c(n2CC)ccc(c3)S(=O)(=O)[O-])sc2c1ccc(c2)S(=O)(=O)[O-].[NH4+].[NH4+]
Complexity:
910
Covalently-bondedUnitCount:
3
HeavyAtomCount:
34
HydrogenBondAcceptorCount:
12
HydrogenBondDonorCount:
4
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
__
Xlogp3:
__