AA40664
1311197-78-0 | 1-(4-Bromo-3-methylphenyl)pentan-1-one
Manufacturer: A2B Chem
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CatalogNumber
AA40664
ChemicalName
1-(4-Bromo-3-methylphenyl)pentan-1-one
CasNumber
1311197-78-0
MolecularFormula
C12H15BrO
MolecularWeight
255.1509
MdlNumber
MFCD19237230
Smiles
CCCCC(=O)c1ccc(c(c1)C)Br
Complexity
191
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
1
RotatableBondCount
4
Xlogp3
4
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CatalogNumber: AA40664
ChemicalName: 1-(4-Bromo-3-methylphenyl)pentan-1-one
CasNumber: 1311197-78-0
MolecularFormula: C12H15BrO
MolecularWeight: 255.1509
MdlNumber: MFCD19237230
Smiles: CCCCC(=O)c1ccc(c(c1)C)Br
Complexity: 191
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
RotatableBondCount: 4
Xlogp3: 4
CatalogNumber:
AA40664
ChemicalName:
1-(4-Bromo-3-methylphenyl)pentan-1-one
CasNumber:
1311197-78-0
MolecularFormula:
C12H15BrO
MolecularWeight:
255.1509
MdlNumber:
MFCD19237230
Smiles:
CCCCC(=O)c1ccc(c(c1)C)Br
Complexity:
191
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
RotatableBondCount:
4
Xlogp3:
4
CatalogNumber: AA40665
ChemicalName: 3-(Tetrahydro-2H-pyran-2-ylmethoxy)phenylboronic acid
CasNumber: 1311185-12-2
MolecularFormula: C12H17BO4
MolecularWeight: 236.072
MdlNumber: MFCD12080516
Smiles: OB(c1cccc(c1)OCC1CCCCO1)O
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: __
CatalogNumber:
AA40665
ChemicalName:
3-(Tetrahydro-2H-pyran-2-ylmethoxy)phenylboronic acid
CasNumber:
1311185-12-2
MolecularFormula:
C12H17BO4
MolecularWeight:
236.072
MdlNumber:
MFCD12080516
Smiles:
OB(c1cccc(c1)OCC1CCCCO1)O
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
__
CatalogNumber: AA40666
ChemicalName: 2-(Cyclopentyloxy)phenylboronic acid
CasNumber: 1311159-02-0
MolecularFormula: C11H15BO3
MolecularWeight: 206.046
MdlNumber: MFCD11183156
Smiles: OB(c1ccccc1OC1CCCC1)O
Complexity: 192
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AA40666
ChemicalName:
2-(Cyclopentyloxy)phenylboronic acid
CasNumber:
1311159-02-0
MolecularFormula:
C11H15BO3
MolecularWeight:
206.046
MdlNumber:
MFCD11183156
Smiles:
OB(c1ccccc1OC1CCCC1)O
Complexity:
192
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(nc1)Oc1ccc(c(c1)OC(F)(F)F)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(nc1)Oc1ccc(c(c1)OC(F)(F)F)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__