AD94455
847805-30-5 | (S)-6-(Hydroxymethyl)morpholin-3-one
Manufacturer: A2B Chem
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CatalogNumber
AD94455
ChemicalName
(S)-6-(Hydroxymethyl)morpholin-3-one
CasNumber
847805-30-5
MolecularFormula
C5H9NO3
MolecularWeight
131.1299
MdlNumber
MFCD09260720
Smiles
OC[C@@H]1CNC(=O)CO1
Complexity
115
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-1.4
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CatalogNumber: AD94455
ChemicalName: (S)-6-(Hydroxymethyl)morpholin-3-one
CasNumber: 847805-30-5
MolecularFormula: C5H9NO3
MolecularWeight: 131.1299
MdlNumber: MFCD09260720
Smiles: OC[C@@H]1CNC(=O)CO1
Complexity: 115
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -1.4
CatalogNumber:
AD94455
ChemicalName:
(S)-6-(Hydroxymethyl)morpholin-3-one
CasNumber:
847805-30-5
MolecularFormula:
C5H9NO3
MolecularWeight:
131.1299
MdlNumber:
MFCD09260720
Smiles:
OC[C@@H]1CNC(=O)CO1
Complexity:
115
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-1.4
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: OC[C@H](CNC(=O)CCl)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC[C@H](CNC(=O)CCl)O
Complexity:
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DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: NN=c1[nH]c(F)c(cc1F)F
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HydrogenBondDonorCount: __
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Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
NN=c1[nH]c(F)c(cc1F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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Smiles: Fc1ncc(c(c1F)Br)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ncc(c(c1F)Br)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__