AB49451
4031-15-6 | 1H-pyrrol-2(5H)-one
Manufacturer: A2B Chem
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CatalogNumber
AB49451
ChemicalName
1H-pyrrol-2(5H)-one
CasNumber
4031-15-6
MolecularFormula
C4H5NO
MolecularWeight
83.0886
MdlNumber
MFCD06658513
Smiles
C1NC(=O)C=C1
Complexity
95.7
Covalently-bondedUnitCount
1
HeavyAtomCount
6
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
-0.4
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CatalogNumber: AB49451
ChemicalName: 1H-pyrrol-2(5H)-one
CasNumber: 4031-15-6
MolecularFormula: C4H5NO
MolecularWeight: 83.0886
MdlNumber: MFCD06658513
Smiles: C1NC(=O)C=C1
Complexity: 95.7
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.4
CatalogNumber:
AB49451
ChemicalName:
1H-pyrrol-2(5H)-one
CasNumber:
4031-15-6
MolecularFormula:
C4H5NO
MolecularWeight:
83.0886
MdlNumber:
MFCD06658513
Smiles:
C1NC(=O)C=C1
Complexity:
95.7
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc2c(c1)c(OCC1CO1)ccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccc2c(c1)c(OCC1CO1)ccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN.Cl
Complexity: 2
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN.Cl
Complexity:
2
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB49454
ChemicalName: 4-(Bromoacetyl)morpholine
CasNumber: 40299-87-4
MolecularFormula: C6H10BrNO2
MolecularWeight: 208.0531
MdlNumber: MFCD06800306
Smiles: BrCC(=O)N1CCOCC1
Complexity: 123
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 0.1
CatalogNumber:
AB49454
ChemicalName:
4-(Bromoacetyl)morpholine
CasNumber:
40299-87-4
MolecularFormula:
C6H10BrNO2
MolecularWeight:
208.0531
MdlNumber:
MFCD06800306
Smiles:
BrCC(=O)N1CCOCC1
Complexity:
123
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.1