AX55520
2096338-51-9 | 2-(Bromoacetamido)phenylboronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AX55520
ChemicalName
2-(Bromoacetamido)phenylboronic acid pinacol ester
CasNumber
2096338-51-9
MolecularFormula
C14H19BBrNO3
MolecularWeight
340.0206
MdlNumber
MFCD18434470
Smiles
BrCC(=O)Nc1ccccc1B1OC(C(O1)(C)C)(C)C
Complexity
359
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AX55520
ChemicalName: 2-(Bromoacetamido)phenylboronic acid pinacol ester
CasNumber: 2096338-51-9
MolecularFormula: C14H19BBrNO3
MolecularWeight: 340.0206
MdlNumber: MFCD18434470
Smiles: BrCC(=O)Nc1ccccc1B1OC(C(O1)(C)C)(C)C
Complexity: 359
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AX55520
ChemicalName:
2-(Bromoacetamido)phenylboronic acid pinacol ester
CasNumber:
2096338-51-9
MolecularFormula:
C14H19BBrNO3
MolecularWeight:
340.0206
MdlNumber:
MFCD18434470
Smiles:
BrCC(=O)Nc1ccccc1B1OC(C(O1)(C)C)(C)C
Complexity:
359
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: AX55521
ChemicalName: 4-Butoxy-3-chloro-5-fluorophenylboronic acid
CasNumber: 2096338-35-9
MolecularFormula: C10H13BClFO3
MolecularWeight: 246.4708
MdlNumber: MFCD20441805
Smiles: CCCCOc1c(F)cc(cc1Cl)B(O)O
Complexity: 209
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AX55521
ChemicalName:
4-Butoxy-3-chloro-5-fluorophenylboronic acid
CasNumber:
2096338-35-9
MolecularFormula:
C10H13BClFO3
MolecularWeight:
246.4708
MdlNumber:
MFCD20441805
Smiles:
CCCCOc1c(F)cc(cc1Cl)B(O)O
Complexity:
209
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5
CatalogNumber: AX55522
ChemicalName: 3-Butanoyl-4-fluorophenylboronic acid
CasNumber: 2096332-56-6
MolecularFormula: C10H12BFO3
MolecularWeight: 210.0099
MdlNumber: MFCD19237170
Smiles: CCCC(=O)c1cc(ccc1F)B(O)O
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55522
ChemicalName:
3-Butanoyl-4-fluorophenylboronic acid
CasNumber:
2096332-56-6
MolecularFormula:
C10H12BFO3
MolecularWeight:
210.0099
MdlNumber:
MFCD19237170
Smiles:
CCCC(=O)c1cc(ccc1F)B(O)O
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
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Smiles: BrCc1ccc(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity: 369
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
BrCc1ccc(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity:
369
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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