AB66261
66899-02-3 | 4,4-Dimethyl-2-pyrrolidinone
Manufacturer: A2B Chem
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CatalogNumber
AB66261
ChemicalName
4,4-Dimethyl-2-pyrrolidinone
CasNumber
66899-02-3
MolecularFormula
C6H11NO
MolecularWeight
113.1576
MdlNumber
MFCD09864496
Smiles
O=C1NCC(C1)(C)C
Complexity
118
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
0.4
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CatalogNumber: AB66261
ChemicalName: 4,4-Dimethyl-2-pyrrolidinone
CasNumber: 66899-02-3
MolecularFormula: C6H11NO
MolecularWeight: 113.1576
MdlNumber: MFCD09864496
Smiles: O=C1NCC(C1)(C)C
Complexity: 118
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.4
CatalogNumber:
AB66261
ChemicalName:
4,4-Dimethyl-2-pyrrolidinone
CasNumber:
66899-02-3
MolecularFormula:
C6H11NO
MolecularWeight:
113.1576
MdlNumber:
MFCD09864496
Smiles:
O=C1NCC(C1)(C)C
Complexity:
118
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.4
CatalogNumber: AB66262
ChemicalName: 4,4-Dimethyl-3-thiosemicarbazide
CasNumber: 6926-58-5
MolecularFormula: C3H9N3S
MolecularWeight: 119.1887
MdlNumber: MFCD00041308
Smiles: NNC(=S)N(C)C
Complexity: 70.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: -0.3
CatalogNumber:
AB66262
ChemicalName:
4,4-Dimethyl-3-thiosemicarbazide
CasNumber:
6926-58-5
MolecularFormula:
C3H9N3S
MolecularWeight:
119.1887
MdlNumber:
MFCD00041308
Smiles:
NNC(=S)N(C)C
Complexity:
70.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
-0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(c1ccc(cc1)C)c1ccc(cc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(c1ccc(cc1)C)c1ccc(cc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(=O)c1ccc(cc1)C)c1ccc(cc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C(=O)c1ccc(cc1)C)c1ccc(cc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__