AB65486
63593-03-3 | 3-O-Benzyl-4-(hydroxymethyl-1,2-o-isopropylidene)-alpha-d-erythropentofuranose
Manufacturer: A2B Chem
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CatalogNumber
AB65486
ChemicalName
3-O-Benzyl-4-(hydroxymethyl-1,2-o-isopropylidene)-alpha-d-erythropentofuranose
CasNumber
63593-03-3
MolecularFormula
C16H22O6
MolecularWeight
310.3423
MdlNumber
MFCD08704144
Smiles
OCC1(CO)O[C@H]2[C@@H]([C@@H]1OCc1ccccc1)OC(O2)(C)C
Complexity
375
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
3
HeavyAtomCount
22
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
0.2
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CatalogNumber: AB65486
ChemicalName: 3-O-Benzyl-4-(hydroxymethyl-1,2-o-isopropylidene)-alpha-d-erythropentofuranose
CasNumber: 63593-03-3
MolecularFormula: C16H22O6
MolecularWeight: 310.3423
MdlNumber: MFCD08704144
Smiles: OCC1(CO)O[C@H]2[C@@H]([C@@H]1OCc1ccccc1)OC(O2)(C)C
Complexity: 375
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 3
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 0.2
CatalogNumber:
AB65486
ChemicalName:
3-O-Benzyl-4-(hydroxymethyl-1,2-o-isopropylidene)-alpha-d-erythropentofuranose
CasNumber:
63593-03-3
MolecularFormula:
C16H22O6
MolecularWeight:
310.3423
MdlNumber:
MFCD08704144
Smiles:
OCC1(CO)O[C@H]2[C@@H]([C@@H]1OCc1ccccc1)OC(O2)(C)C
Complexity:
375
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
3
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC(=O)CC
Complexity: 76.6
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCC(=O)CC
Complexity:
76.6
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCC/C=C/C(O)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCC/C=C/C(O)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC=CC(O)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC=CC(O)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__