AB64349
61049-67-0 | 3-(Benzyloxy)-4H-pyran-4-one
Manufacturer: A2B Chem
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CatalogNumber
AB64349
ChemicalName
3-(Benzyloxy)-4H-pyran-4-one
CasNumber
61049-67-0
MolecularFormula
C12H10O3
MolecularWeight
202.206
MdlNumber
MFCD14156109
Smiles
O=c1ccocc1OCc1ccccc1
Complexity
285
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.8
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CatalogNumber: AB64349
ChemicalName: 3-(Benzyloxy)-4H-pyran-4-one
CasNumber: 61049-67-0
MolecularFormula: C12H10O3
MolecularWeight: 202.206
MdlNumber: MFCD14156109
Smiles: O=c1ccocc1OCc1ccccc1
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AB64349
ChemicalName:
3-(Benzyloxy)-4H-pyran-4-one
CasNumber:
61049-67-0
MolecularFormula:
C12H10O3
MolecularWeight:
202.206
MdlNumber:
MFCD14156109
Smiles:
O=c1ccocc1OCc1ccccc1
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: AB64350
ChemicalName: 3-(Benzyloxy)-6-bromo-2-fluorophenylboronic acid
CasNumber: 957035-10-8
MolecularFormula: C13H11BBrFO3
MolecularWeight: 324.938
MdlNumber: MFCD09475868
Smiles: OB(c1c(Br)ccc(c1F)OCc1ccccc1)O
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: __
CatalogNumber:
AB64350
ChemicalName:
3-(Benzyloxy)-6-bromo-2-fluorophenylboronic acid
CasNumber:
957035-10-8
MolecularFormula:
C13H11BBrFO3
MolecularWeight:
324.938
MdlNumber:
MFCD09475868
Smiles:
OB(c1c(Br)ccc(c1F)OCc1ccccc1)O
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1cccc(c1)OCc1ccccc1
Complexity: 209
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1cccc(c1)OCc1ccccc1
Complexity:
209
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.3
CatalogNumber: AB64352
ChemicalName: 3-(Benzyloxy)benzoic acid
CasNumber: 69026-14-8
MolecularFormula: C14H12O3
MolecularWeight: 228.24328
MdlNumber: MFCD00527901
Smiles: OC(=O)c1cccc(c1)OCc1ccccc1
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 3.3
CatalogNumber:
AB64352
ChemicalName:
3-(Benzyloxy)benzoic acid
CasNumber:
69026-14-8
MolecularFormula:
C14H12O3
MolecularWeight:
228.24328
MdlNumber:
MFCD00527901
Smiles:
OC(=O)c1cccc(c1)OCc1ccccc1
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
3.3