AI52356
551-68-8 | D-Psicose
Manufacturer: A2B Chem
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CatalogNumber
AI52356
ChemicalName
D-Psicose
CasNumber
551-68-8
MolecularFormula
C6H12O6
MolecularWeight
180.1559
MdlNumber
MFCD00083478
Smiles
OC[C@@]1(O)OC[C@H]([C@H]([C@H]1O)O)O
Complexity
147
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
3
HeavyAtomCount
12
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
5
RotatableBondCount
5
Xlogp3
-3.2
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CatalogNumber: AI52356
ChemicalName: D-Psicose
CasNumber: 551-68-8
MolecularFormula: C6H12O6
MolecularWeight: 180.1559
MdlNumber: MFCD00083478
Smiles: OC[C@@]1(O)OC[C@H]([C@H]([C@H]1O)O)O
Complexity: 147
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 3
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 5
RotatableBondCount: 5
Xlogp3: -3.2
CatalogNumber:
AI52356
ChemicalName:
D-Psicose
CasNumber:
551-68-8
MolecularFormula:
C6H12O6
MolecularWeight:
180.1559
MdlNumber:
MFCD00083478
Smiles:
OC[C@@]1(O)OC[C@H]([C@H]([C@H]1O)O)O
Complexity:
147
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
3
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
5
RotatableBondCount:
5
Xlogp3:
-3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(c1cccc(c1O)C(CC)C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCC(c1cccc(c1O)C(CC)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(OC(=O)c1cccc(c1)Cl)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(OC(=O)c1cccc(c1)Cl)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O1C[C@@H]2[C@H](C1)CN(C2)Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O1C[C@@H]2[C@H](C1)CN(C2)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__