AB48086
845870-55-5 | 4-(N-Methylamino)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB48086
ChemicalName
4-(N-Methylamino)phenylboronic acid, pinacol ester
CasNumber
845870-55-5
MolecularFormula
C13H20BNO2
MolecularWeight
233.1144
MdlNumber
MFCD06795668
Smiles
CNc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
257
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AB48086
ChemicalName: 4-(N-Methylamino)phenylboronic acid, pinacol ester
CasNumber: 845870-55-5
MolecularFormula: C13H20BNO2
MolecularWeight: 233.1144
MdlNumber: MFCD06795668
Smiles: CNc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AB48086
ChemicalName:
4-(N-Methylamino)phenylboronic acid, pinacol ester
CasNumber:
845870-55-5
MolecularFormula:
C13H20BNO2
MolecularWeight:
233.1144
MdlNumber:
MFCD06795668
Smiles:
CNc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: AB48087
ChemicalName: 4-(3-(Dimethylamino)propylcarbamoyl)phenylboronic acid, pinacol ester
CasNumber: 832114-10-0
MolecularFormula: C18H29BN2O3
MolecularWeight: 332.2455
MdlNumber: MFCD05864306
Smiles: CN(CCCNC(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 416
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 6
CatalogNumber:
AB48087
ChemicalName:
4-(3-(Dimethylamino)propylcarbamoyl)phenylboronic acid, pinacol ester
CasNumber:
832114-10-0
MolecularFormula:
C18H29BN2O3
MolecularWeight:
332.2455
MdlNumber:
MFCD05864306
Smiles:
CN(CCCNC(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
416
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
6
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Smiles: COc1nccc(c1N)C(=O)O
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Smiles:
COc1nccc(c1N)C(=O)O
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Smiles: Cc1c(O)cc(=O)[nH]c1C
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
Cc1c(O)cc(=O)[nH]c1C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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