AI37876
1613259-71-4 | 4-(N-Methylaminomethyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI37876
ChemicalName
4-(N-Methylaminomethyl)phenylboronic acid, pinacol ester
CasNumber
1613259-71-4
MolecularFormula
C14H22BNO2
MolecularWeight
247.141
MdlNumber
MFCD18733526
Smiles
CNCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
270
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AI37876
ChemicalName: 4-(N-Methylaminomethyl)phenylboronic acid, pinacol ester
CasNumber: 1613259-71-4
MolecularFormula: C14H22BNO2
MolecularWeight: 247.141
MdlNumber: MFCD18733526
Smiles: CNCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 270
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AI37876
ChemicalName:
4-(N-Methylaminomethyl)phenylboronic acid, pinacol ester
CasNumber:
1613259-71-4
MolecularFormula:
C14H22BNO2
MolecularWeight:
247.141
MdlNumber:
MFCD18733526
Smiles:
CNCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
270
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
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Smiles: OC1(CCOCC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
OC1(CCOCC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
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Smiles: O=C(OC1CCCC=CCC1)NCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O
Complexity: __
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Smiles:
O=C(OC1CCCC=CCC1)NCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: Cc1nc(cs1)C=CC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Cc1nc(cs1)C=CC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__