AB52629
62400-75-3 | 5-(Hydroxymethyl)pyrrolidin-2-one
Manufacturer: A2B Chem
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CatalogNumber
AB52629
ChemicalName
5-(Hydroxymethyl)pyrrolidin-2-one
CasNumber
62400-75-3
MolecularFormula
C5H9NO2
MolecularWeight
115.1305
MdlNumber
MFCD06661931
Smiles
OCC1CCC(=O)N1
Complexity
103
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
-1
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CatalogNumber: AB52629
ChemicalName: 5-(Hydroxymethyl)pyrrolidin-2-one
CasNumber: 62400-75-3
MolecularFormula: C5H9NO2
MolecularWeight: 115.1305
MdlNumber: MFCD06661931
Smiles: OCC1CCC(=O)N1
Complexity: 103
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: -1
CatalogNumber:
AB52629
ChemicalName:
5-(Hydroxymethyl)pyrrolidin-2-one
CasNumber:
62400-75-3
MolecularFormula:
C5H9NO2
MolecularWeight:
115.1305
MdlNumber:
MFCD06661931
Smiles:
OCC1CCC(=O)N1
Complexity:
103
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
-1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Oc1ccc(cc1)Cn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Oc1ccc(cc1)Cn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1Cc2c(C1)cccc2O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1Cc2c(C1)cccc2O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@H](c1ccc(c(c1)Cl)C)N.Cl
Complexity: 127
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@H](c1ccc(c(c1)Cl)C)N.Cl
Complexity:
127
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__