AX55581
2096337-62-9 | 3-(Acetyloxy)-4-nitrophenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX55581
ChemicalName
3-(Acetyloxy)-4-nitrophenylboronic acid
CasNumber
2096337-62-9
MolecularFormula
C8H8BNO6
MolecularWeight
224.9632
MdlNumber
MFCD19684104
Smiles
CC(=O)Oc1cc(ccc1[N+](=O)[O-])B(O)O
Complexity
278
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AX55581
ChemicalName: 3-(Acetyloxy)-4-nitrophenylboronic acid
CasNumber: 2096337-62-9
MolecularFormula: C8H8BNO6
MolecularWeight: 224.9632
MdlNumber: MFCD19684104
Smiles: CC(=O)Oc1cc(ccc1[N+](=O)[O-])B(O)O
Complexity: 278
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55581
ChemicalName:
3-(Acetyloxy)-4-nitrophenylboronic acid
CasNumber:
2096337-62-9
MolecularFormula:
C8H8BNO6
MolecularWeight:
224.9632
MdlNumber:
MFCD19684104
Smiles:
CC(=O)Oc1cc(ccc1[N+](=O)[O-])B(O)O
Complexity:
278
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(cc1B1OC(C(O1)(C)C)(C)C)CN1CCOCC1
Complexity: 399
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(cc1B1OC(C(O1)(C)C)(C)C)CN1CCOCC1
Complexity:
399
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55583
ChemicalName: 3-Bromo-5-chloro-2-ethoxyphenylboronic acid
CasNumber: 2096341-59-0
MolecularFormula: C8H9BBrClO3
MolecularWeight: 279.3233
MdlNumber: MFCD19981506
Smiles: CCOc1c(Br)cc(cc1B(O)O)Cl
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55583
ChemicalName:
3-Bromo-5-chloro-2-ethoxyphenylboronic acid
CasNumber:
2096341-59-0
MolecularFormula:
C8H9BBrClO3
MolecularWeight:
279.3233
MdlNumber:
MFCD19981506
Smiles:
CCOc1c(Br)cc(cc1B(O)O)Cl
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AX55584
ChemicalName: 4-Fluoro-2-(N-propylaminomethyl)phenylboronic acid pinacol ester, HCl
CasNumber: 2096330-19-5
MolecularFormula: C16H26BClFNO2
MolecularWeight: 329.6455
MdlNumber: MFCD20529517
Smiles: CCCNCc1cc(F)ccc1B1OC(C(O1)(C)C)(C)C.Cl
Complexity: 335
Covalently-bondedUnitCount: 2
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AX55584
ChemicalName:
4-Fluoro-2-(N-propylaminomethyl)phenylboronic acid pinacol ester, HCl
CasNumber:
2096330-19-5
MolecularFormula:
C16H26BClFNO2
MolecularWeight:
329.6455
MdlNumber:
MFCD20529517
Smiles:
CCCNCc1cc(F)ccc1B1OC(C(O1)(C)C)(C)C.Cl
Complexity:
335
Covalently-bondedUnitCount:
2
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5