AA54617
1218791-23-1 | 4-(N-t-Butylamino)-3-nitrophenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA54617
ChemicalName
4-(N-t-Butylamino)-3-nitrophenylboronic acid, pinacol ester
CasNumber
1218791-23-1
MolecularFormula
C16H25BN2O4
MolecularWeight
320.1917
MdlNumber
MFCD21848380
Smiles
[O-][N+](=O)c1cc(ccc1NC(C)(C)C)B1OC(C(O1)(C)C)(C)C
Complexity
440
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AA54617
ChemicalName: 4-(N-t-Butylamino)-3-nitrophenylboronic acid, pinacol ester
CasNumber: 1218791-23-1
MolecularFormula: C16H25BN2O4
MolecularWeight: 320.1917
MdlNumber: MFCD21848380
Smiles: [O-][N+](=O)c1cc(ccc1NC(C)(C)C)B1OC(C(O1)(C)C)(C)C
Complexity: 440
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AA54617
ChemicalName:
4-(N-t-Butylamino)-3-nitrophenylboronic acid, pinacol ester
CasNumber:
1218791-23-1
MolecularFormula:
C16H25BN2O4
MolecularWeight:
320.1917
MdlNumber:
MFCD21848380
Smiles:
[O-][N+](=O)c1cc(ccc1NC(C)(C)C)B1OC(C(O1)(C)C)(C)C
Complexity:
440
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: AA54618
ChemicalName: 4-Ethoxy-3-nitrophenylboronic acid, pinacol ester
CasNumber: 1218791-20-8
MolecularFormula: C14H20BNO5
MolecularWeight: 293.1233
MdlNumber: MFCD12913978
Smiles: CCOc1ccc(cc1[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Complexity: 379
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 3
CatalogNumber:
AA54618
ChemicalName:
4-Ethoxy-3-nitrophenylboronic acid, pinacol ester
CasNumber:
1218791-20-8
MolecularFormula:
C14H20BNO5
MolecularWeight:
293.1233
MdlNumber:
MFCD12913978
Smiles:
CCOc1ccc(cc1[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Complexity:
379
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
3
CatalogNumber: AA54619
ChemicalName: 2,3-Difluoro-5-(methoxycarbonyl)phenylboronic acid, pinacol ester
CasNumber: 1218791-19-5
MolecularFormula: C14H17BF2O4
MolecularWeight: 298.0902
MdlNumber: MFCD12026086
Smiles: COC(=O)c1cc(F)c(c(c1)B1OC(C(O1)(C)C)(C)C)F
Complexity: 400
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: __
RotatableBondCount: 3
CatalogNumber:
AA54619
ChemicalName:
2,3-Difluoro-5-(methoxycarbonyl)phenylboronic acid, pinacol ester
CasNumber:
1218791-19-5
MolecularFormula:
C14H17BF2O4
MolecularWeight:
298.0902
MdlNumber:
MFCD12026086
Smiles:
COC(=O)c1cc(F)c(c(c1)B1OC(C(O1)(C)C)(C)C)F
Complexity:
400
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
__
RotatableBondCount:
3
CatalogNumber: AA54620
ChemicalName: 2-Methoxy-5-nitropyridine-3-boronic acid, pinacol ester
CasNumber: 1218791-18-4
MolecularFormula: C12H17BN2O5
MolecularWeight: 280.0848
MdlNumber: MFCD08063082
Smiles: COc1ncc(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity: 369
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: __
RotatableBondCount: 2
CatalogNumber:
AA54620
ChemicalName:
2-Methoxy-5-nitropyridine-3-boronic acid, pinacol ester
CasNumber:
1218791-18-4
MolecularFormula:
C12H17BN2O5
MolecularWeight:
280.0848
MdlNumber:
MFCD08063082
Smiles:
COc1ncc(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity:
369
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
__
RotatableBondCount:
2