AD94836
850568-67-1 | 4-(2-Cyanopropan-2-yl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AD94836
ChemicalName
4-(2-Cyanopropan-2-yl)phenylboronic acid
CasNumber
850568-67-1
MolecularFormula
C10H12BNO2
MolecularWeight
189.0188
MdlNumber
MFCD06659832
Smiles
OB(c1ccc(cc1)C(C#N)(C)C)O
Complexity
236
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AD94836
ChemicalName: 4-(2-Cyanopropan-2-yl)phenylboronic acid
CasNumber: 850568-67-1
MolecularFormula: C10H12BNO2
MolecularWeight: 189.0188
MdlNumber: MFCD06659832
Smiles: OB(c1ccc(cc1)C(C#N)(C)C)O
Complexity: 236
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AD94836
ChemicalName:
4-(2-Cyanopropan-2-yl)phenylboronic acid
CasNumber:
850568-67-1
MolecularFormula:
C10H12BNO2
MolecularWeight:
189.0188
MdlNumber:
MFCD06659832
Smiles:
OB(c1ccc(cc1)C(C#N)(C)C)O
Complexity:
236
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: AD94837
ChemicalName: 1-BOC-6-methoxyindole-2-boronic acid
CasNumber: 850568-65-9
MolecularFormula: C14H18BNO5
MolecularWeight: 291.1074
MdlNumber: MFCD06659830
Smiles: COc1ccc2c(c1)n(C(=O)OC(C)(C)C)c(c2)B(O)O
Complexity: 384
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AD94837
ChemicalName:
1-BOC-6-methoxyindole-2-boronic acid
CasNumber:
850568-65-9
MolecularFormula:
C14H18BNO5
MolecularWeight:
291.1074
MdlNumber:
MFCD06659830
Smiles:
COc1ccc2c(c1)n(C(=O)OC(C)(C)C)c(c2)B(O)O
Complexity:
384
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AD94838
ChemicalName: 5-Benzyloxy-1-BOC-indole-2-boronic acid
CasNumber: 850568-62-6
MolecularFormula: C20H22BNO5
MolecularWeight: 367.20338000000004
MdlNumber: MFCD06659824
Smiles: OB(c1cc2c(n1C(=O)OC(C)(C)C)ccc(c2)OCc1ccccc1)O
Complexity: 503
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 6
CatalogNumber:
AD94838
ChemicalName:
5-Benzyloxy-1-BOC-indole-2-boronic acid
CasNumber:
850568-62-6
MolecularFormula:
C20H22BNO5
MolecularWeight:
367.20338000000004
MdlNumber:
MFCD06659824
Smiles:
OB(c1cc2c(n1C(=O)OC(C)(C)C)ccc(c2)OCc1ccccc1)O
Complexity:
503
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
6
CatalogNumber: AD94839
ChemicalName: 4-Aminomethylphenylboronic acid, pinacol ester, HCl
CasNumber: 850568-55-7
MolecularFormula: C13H21BClNO2
MolecularWeight: 269.5753
MdlNumber: MFCD02179455
Smiles: NCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C.Cl
Complexity: 257
Covalently-bondedUnitCount: 2
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AD94839
ChemicalName:
4-Aminomethylphenylboronic acid, pinacol ester, HCl
CasNumber:
850568-55-7
MolecularFormula:
C13H21BClNO2
MolecularWeight:
269.5753
MdlNumber:
MFCD02179455
Smiles:
NCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C.Cl
Complexity:
257
Covalently-bondedUnitCount:
2
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2