AX55171
2096340-36-0 | 4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester, HCl
Manufacturer: A2B Chem
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CatalogNumber
AX55171
ChemicalName
4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester, HCl
CasNumber
2096340-36-0
MolecularFormula
C17H29BClNO2
MolecularWeight
325.6817
MdlNumber
MFCD19237204
Smiles
CCN(Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)CC.Cl
Complexity
318
Covalently-bondedUnitCount
2
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
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CatalogNumber: AX55171
ChemicalName: 4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester, HCl
CasNumber: 2096340-36-0
MolecularFormula: C17H29BClNO2
MolecularWeight: 325.6817
MdlNumber: MFCD19237204
Smiles: CCN(Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)CC.Cl
Complexity: 318
Covalently-bondedUnitCount: 2
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
CatalogNumber:
AX55171
ChemicalName:
4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester, HCl
CasNumber:
2096340-36-0
MolecularFormula:
C17H29BClNO2
MolecularWeight:
325.6817
MdlNumber:
MFCD19237204
Smiles:
CCN(Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)CC.Cl
Complexity:
318
Covalently-bondedUnitCount:
2
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1ccc(nc1F)OCC(C)C)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1ccc(nc1F)OCC(C)C)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55173
ChemicalName: 2-Chloro-5-methoxy-4-methylbenzeneboronic acid
CasNumber: 2096335-81-6
MolecularFormula: C8H10BClO3
MolecularWeight: 200.4272
MdlNumber: MFCD11870203
Smiles: COc1cc(B(O)O)c(cc1C)Cl
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AX55173
ChemicalName:
2-Chloro-5-methoxy-4-methylbenzeneboronic acid
CasNumber:
2096335-81-6
MolecularFormula:
C8H10BClO3
MolecularWeight:
200.4272
MdlNumber:
MFCD11870203
Smiles:
COc1cc(B(O)O)c(cc1C)Cl
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNCc1ccc(cc1B1OC(C(O1)(C)C)(C)C)F
Complexity: 309
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNCc1ccc(cc1B1OC(C(O1)(C)C)(C)C)F
Complexity:
309
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__