AX55476
2096337-36-7 | 2-Chloro-4-(N-t-butylaminomethyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AX55476
ChemicalName
2-Chloro-4-(N-t-butylaminomethyl)phenylboronic acid, pinacol ester
CasNumber
2096337-36-7
MolecularFormula
C17H27BClNO2
MolecularWeight
323.6658
MdlNumber
MFCD18311897
Smiles
Clc1cc(ccc1B1OC(C(O1)(C)C)(C)C)CNC(C)(C)C
Complexity
379
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
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CatalogNumber: AX55476
ChemicalName: 2-Chloro-4-(N-t-butylaminomethyl)phenylboronic acid, pinacol ester
CasNumber: 2096337-36-7
MolecularFormula: C17H27BClNO2
MolecularWeight: 323.6658
MdlNumber: MFCD18311897
Smiles: Clc1cc(ccc1B1OC(C(O1)(C)C)(C)C)CNC(C)(C)C
Complexity: 379
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
CatalogNumber:
AX55476
ChemicalName:
2-Chloro-4-(N-t-butylaminomethyl)phenylboronic acid, pinacol ester
CasNumber:
2096337-36-7
MolecularFormula:
C17H27BClNO2
MolecularWeight:
323.6658
MdlNumber:
MFCD18311897
Smiles:
Clc1cc(ccc1B1OC(C(O1)(C)C)(C)C)CNC(C)(C)C
Complexity:
379
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1(CC1)c1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C
Complexity: 459
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1(CC1)c1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C
Complexity:
459
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55478
ChemicalName: 3-Chloro-5-ethoxy-4-fluorophenylboronic acid
CasNumber: 2096339-86-3
MolecularFormula: C8H9BClFO3
MolecularWeight: 218.4177
MdlNumber: MFCD20441834
Smiles: CCOc1cc(cc(c1F)Cl)B(O)O
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55478
ChemicalName:
3-Chloro-5-ethoxy-4-fluorophenylboronic acid
CasNumber:
2096339-86-3
MolecularFormula:
C8H9BClFO3
MolecularWeight:
218.4177
MdlNumber:
MFCD20441834
Smiles:
CCOc1cc(cc(c1F)Cl)B(O)O
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AX55479
ChemicalName: 3-Chloro-4-ethoxy-5-isopropoxyphenylboronic acid
CasNumber: 2096336-82-0
MolecularFormula: C11H16BClO4
MolecularWeight: 258.5063
MdlNumber: MFCD21332923
Smiles: CCOc1c(OC(C)C)cc(cc1Cl)B(O)O
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AX55479
ChemicalName:
3-Chloro-4-ethoxy-5-isopropoxyphenylboronic acid
CasNumber:
2096336-82-0
MolecularFormula:
C11H16BClO4
MolecularWeight:
258.5063
MdlNumber:
MFCD21332923
Smiles:
CCOc1c(OC(C)C)cc(cc1Cl)B(O)O
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5