AX55219
2096339-48-7 | [4-Chloro-2-methyl-5-(pyridin-3-ylmethoxy)phenyl]boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX55219
ChemicalName
[4-Chloro-2-methyl-5-(pyridin-3-ylmethoxy)phenyl]boronic acid
CasNumber
2096339-48-7
MolecularFormula
C13H13BClNO3
MolecularWeight
277.5112
MdlNumber
MFCD20441813
Smiles
Clc1cc(C)c(cc1OCc1cccnc1)B(O)O
Complexity
283
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AX55219
ChemicalName: [4-Chloro-2-methyl-5-(pyridin-3-ylmethoxy)phenyl]boronic acid
CasNumber: 2096339-48-7
MolecularFormula: C13H13BClNO3
MolecularWeight: 277.5112
MdlNumber: MFCD20441813
Smiles: Clc1cc(C)c(cc1OCc1cccnc1)B(O)O
Complexity: 283
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55219
ChemicalName:
[4-Chloro-2-methyl-5-(pyridin-3-ylmethoxy)phenyl]boronic acid
CasNumber:
2096339-48-7
MolecularFormula:
C13H13BClNO3
MolecularWeight:
277.5112
MdlNumber:
MFCD20441813
Smiles:
Clc1cc(C)c(cc1OCc1cccnc1)B(O)O
Complexity:
283
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AX55220
ChemicalName: 3-Chloro-5-(hydroxymethyl)phenylboronic acid
CasNumber: 2121512-87-4
MolecularFormula: C7H8BClO3
MolecularWeight: 186.4006
MdlNumber: MFCD22397986
Smiles: OCc1cc(Cl)cc(c1)B(O)O
Complexity: 145
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AX55220
ChemicalName:
3-Chloro-5-(hydroxymethyl)phenylboronic acid
CasNumber:
2121512-87-4
MolecularFormula:
C7H8BClO3
MolecularWeight:
186.4006
MdlNumber:
MFCD22397986
Smiles:
OCc1cc(Cl)cc(c1)B(O)O
Complexity:
145
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: AX55221
ChemicalName: 2-Piperazinopyridine-3-boronic acid DiHCl
CasNumber: 2096336-81-9
MolecularFormula: C9H16BCl2N3O2
MolecularWeight: 279.9592
MdlNumber: MFCD22205757
Smiles: OB(c1cccnc1N1CCNCC1)O.Cl.Cl
Complexity: 200
Covalently-bondedUnitCount: 3
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 5
RotatableBondCount: 2
CatalogNumber:
AX55221
ChemicalName:
2-Piperazinopyridine-3-boronic acid DiHCl
CasNumber:
2096336-81-9
MolecularFormula:
C9H16BCl2N3O2
MolecularWeight:
279.9592
MdlNumber:
MFCD22205757
Smiles:
OB(c1cccnc1N1CCNCC1)O.Cl.Cl
Complexity:
200
Covalently-bondedUnitCount:
3
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
5
RotatableBondCount:
2
CatalogNumber: AX55222
ChemicalName: 4-Chloro-2-(N-propylaminomethyl)phenylboronic acid, pinacol ester
CasNumber: 2096331-24-5
MolecularFormula: C16H25BClNO2
MolecularWeight: 309.6392
MdlNumber: MFCD20441916
Smiles: CCCNCc1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity: 335
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
CatalogNumber:
AX55222
ChemicalName:
4-Chloro-2-(N-propylaminomethyl)phenylboronic acid, pinacol ester
CasNumber:
2096331-24-5
MolecularFormula:
C16H25BClNO2
MolecularWeight:
309.6392
MdlNumber:
MFCD20441916
Smiles:
CCCNCc1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity:
335
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5