AD94854
850567-51-0 | 3-Aminophenylboronic acid, pinacol ester, HCl
Manufacturer: A2B Chem
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CatalogNumber
AD94854
ChemicalName
3-Aminophenylboronic acid, pinacol ester, HCl
CasNumber
850567-51-0
MolecularFormula
C12H19BClNO2
MolecularWeight
255.5488
MdlNumber
MFCD06659920
Smiles
Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C.Cl
Complexity
252
Covalently-bondedUnitCount
2
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
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CatalogNumber: AD94854
ChemicalName: 3-Aminophenylboronic acid, pinacol ester, HCl
CasNumber: 850567-51-0
MolecularFormula: C12H19BClNO2
MolecularWeight: 255.5488
MdlNumber: MFCD06659920
Smiles: Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C.Cl
Complexity: 252
Covalently-bondedUnitCount: 2
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AD94854
ChemicalName:
3-Aminophenylboronic acid, pinacol ester, HCl
CasNumber:
850567-51-0
MolecularFormula:
C12H19BClNO2
MolecularWeight:
255.5488
MdlNumber:
MFCD06659920
Smiles:
Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C.Cl
Complexity:
252
Covalently-bondedUnitCount:
2
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
CatalogNumber: AD94855
ChemicalName: 3-(4-Cyanophenyl)aminocarbonylphenylboronic acid
CasNumber: 850567-36-1
MolecularFormula: C14H11BN2O3
MolecularWeight: 266.0597
MdlNumber: MFCD06659886
Smiles: N#Cc1ccc(cc1)NC(=O)c1cccc(c1)B(O)O
Complexity: 385
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
CatalogNumber:
AD94855
ChemicalName:
3-(4-Cyanophenyl)aminocarbonylphenylboronic acid
CasNumber:
850567-36-1
MolecularFormula:
C14H11BN2O3
MolecularWeight:
266.0597
MdlNumber:
MFCD06659886
Smiles:
N#Cc1ccc(cc1)NC(=O)c1cccc(c1)B(O)O
Complexity:
385
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
CatalogNumber: AD94856
ChemicalName: 3-(4-Fluorophenyl)aminocarbonylphenylboronic acid
CasNumber: 850567-35-0
MolecularFormula: C13H11BFNO3
MolecularWeight: 259.0407
MdlNumber: MFCD04115712
Smiles: Fc1ccc(cc1)NC(=O)c1cccc(c1)B(O)O
Complexity: 308
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
CatalogNumber:
AD94856
ChemicalName:
3-(4-Fluorophenyl)aminocarbonylphenylboronic acid
CasNumber:
850567-35-0
MolecularFormula:
C13H11BFNO3
MolecularWeight:
259.0407
MdlNumber:
MFCD04115712
Smiles:
Fc1ccc(cc1)NC(=O)c1cccc(c1)B(O)O
Complexity:
308
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: O=C(c1cccc(c1)B(O)O)NC1CCCC1
Complexity: 267
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O=C(c1cccc(c1)B(O)O)NC1CCCC1
Complexity:
267
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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