AB56126
106973-37-9 | (S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB56126
ChemicalName
(S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid
CasNumber
106973-37-9
MolecularFormula
C12H13NO4
MolecularWeight
235.2359
MdlNumber
MFCD09835535
Smiles
OC(=O)[C@@H]1COCC(=O)N1Cc1ccccc1
Complexity
299
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.5
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CatalogNumber: AB56126
ChemicalName: (S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid
CasNumber: 106973-37-9
MolecularFormula: C12H13NO4
MolecularWeight: 235.2359
MdlNumber: MFCD09835535
Smiles: OC(=O)[C@@H]1COCC(=O)N1Cc1ccccc1
Complexity: 299
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.5
CatalogNumber:
AB56126
ChemicalName:
(S)-4-Benzyl-5-oxomorpholine-3-carboxylic acid
CasNumber:
106973-37-9
MolecularFormula:
C12H13NO4
MolecularWeight:
235.2359
MdlNumber:
MFCD09835535
Smiles:
OC(=O)[C@@H]1COCC(=O)N1Cc1ccccc1
Complexity:
299
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H](CCOCc1ccccc1)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H](CCOCc1ccccc1)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC[C@@H](COCc1ccccc1)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC[C@@H](COCc1ccccc1)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB56129
ChemicalName: (S)-4-Benzyl-1,3-thiazolidine-2-thione
CasNumber: 171877-39-7
MolecularFormula: C10H11NS2
MolecularWeight: 209.33104
MdlNumber: MFCD06658216
Smiles: S=C1SC[C@@H](N1)Cc1ccccc1
Complexity: 187
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AB56129
ChemicalName:
(S)-4-Benzyl-1,3-thiazolidine-2-thione
CasNumber:
171877-39-7
MolecularFormula:
C10H11NS2
MolecularWeight:
209.33104
MdlNumber:
MFCD06658216
Smiles:
S=C1SC[C@@H](N1)Cc1ccccc1
Complexity:
187
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.9