AD65534
171364-78-6 | 4-(N,N-Dimethylamino)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AD65534
ChemicalName
4-(N,N-Dimethylamino)phenylboronic acid, pinacol ester
CasNumber
171364-78-6
MolecularFormula
C14H22BNO2
MolecularWeight
247.141
MdlNumber
MFCD05663854
Smiles
CN(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity
280
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
RotatableBondCount
2
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CatalogNumber: AD65534
ChemicalName: 4-(N,N-Dimethylamino)phenylboronic acid, pinacol ester
CasNumber: 171364-78-6
MolecularFormula: C14H22BNO2
MolecularWeight: 247.141
MdlNumber: MFCD05663854
Smiles: CN(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
CatalogNumber:
AD65534
ChemicalName:
4-(N,N-Dimethylamino)phenylboronic acid, pinacol ester
CasNumber:
171364-78-6
MolecularFormula:
C14H22BNO2
MolecularWeight:
247.141
MdlNumber:
MFCD05663854
Smiles:
CN(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
CatalogNumber: AD65535
ChemicalName: Methyl 2-(benzylamino)acetate
CasNumber: 17136-35-5
MolecularFormula: C10H14ClNO2
MolecularWeight: 215.6767
MdlNumber: MFCD03247461
Smiles: COC(=O)CNCc1ccccc1.Cl
Complexity: 153
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
CatalogNumber:
AD65535
ChemicalName:
Methyl 2-(benzylamino)acetate
CasNumber:
17136-35-5
MolecularFormula:
C10H14ClNO2
MolecularWeight:
215.6767
MdlNumber:
MFCD03247461
Smiles:
COC(=O)CNCc1ccccc1.Cl
Complexity:
153
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
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Smiles: CCc1cc2c(o1)ccc(c2)C
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CCc1cc2c(o1)ccc(c2)C
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Smiles: [O-]C(=O)C(C1CCS(=O)(=O)C1)C
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Smiles:
[O-]C(=O)C(C1CCS(=O)(=O)C1)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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