AX55352
2096338-85-9 | 3-Bromo-5-(4-methylpiperazino)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX55352
ChemicalName
3-Bromo-5-(4-methylpiperazino)phenylboronic acid
CasNumber
2096338-85-9
MolecularFormula
C11H16BBrN2O2
MolecularWeight
298.9719
MdlNumber
MFCD18434418
Smiles
CN1CCN(CC1)c1cc(Br)cc(c1)B(O)O
Complexity
250
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AX55352
ChemicalName: 3-Bromo-5-(4-methylpiperazino)phenylboronic acid
CasNumber: 2096338-85-9
MolecularFormula: C11H16BBrN2O2
MolecularWeight: 298.9719
MdlNumber: MFCD18434418
Smiles: CN1CCN(CC1)c1cc(Br)cc(c1)B(O)O
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AX55352
ChemicalName:
3-Bromo-5-(4-methylpiperazino)phenylboronic acid
CasNumber:
2096338-85-9
MolecularFormula:
C11H16BBrN2O2
MolecularWeight:
298.9719
MdlNumber:
MFCD18434418
Smiles:
CN1CCN(CC1)c1cc(Br)cc(c1)B(O)O
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: AX55353
ChemicalName: 3-[(4-Fluorophenyl)(hydroxy)methyl]phenylboronic acid
CasNumber: 2096334-15-3
MolecularFormula: C13H12BFO3
MolecularWeight: 246.042
MdlNumber: MFCD22192457
Smiles: Fc1ccc(cc1)C(c1cccc(c1)B(O)O)O
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
CatalogNumber:
AX55353
ChemicalName:
3-[(4-Fluorophenyl)(hydroxy)methyl]phenylboronic acid
CasNumber:
2096334-15-3
MolecularFormula:
C13H12BFO3
MolecularWeight:
246.042
MdlNumber:
MFCD22192457
Smiles:
Fc1ccc(cc1)C(c1cccc(c1)B(O)O)O
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(Oc1cc(F)c(c(c1)B1OC(C(O1)(C)C)(C)C)F)C
Complexity: 360
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(Oc1cc(F)c(c(c1)B1OC(C(O1)(C)C)(C)C)F)C
Complexity:
360
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55355
ChemicalName: 3-Fluoro-4-pentanoylphenylboronic acid
CasNumber: 2096333-01-4
MolecularFormula: C11H14BFO3
MolecularWeight: 224.0365
MdlNumber: MFCD19684102
Smiles: CCCCC(=O)c1ccc(cc1F)B(O)O
Complexity: 235
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AX55355
ChemicalName:
3-Fluoro-4-pentanoylphenylboronic acid
CasNumber:
2096333-01-4
MolecularFormula:
C11H14BFO3
MolecularWeight:
224.0365
MdlNumber:
MFCD19684102
Smiles:
CCCCC(=O)c1ccc(cc1F)B(O)O
Complexity:
235
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5