AB69053
913836-03-0 | 5-Borononicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AB69053
ChemicalName
5-Borononicotinic acid
CasNumber
913836-03-0
MolecularFormula
C6H6BNO4
MolecularWeight
166.92713999999998
MdlNumber
MFCD02323212
Smiles
OB(c1cncc(c1)C(=O)O)O
Complexity
175
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AB69053
ChemicalName: 5-Borononicotinic acid
CasNumber: 913836-03-0
MolecularFormula: C6H6BNO4
MolecularWeight: 166.92713999999998
MdlNumber: MFCD02323212
Smiles: OB(c1cncc(c1)C(=O)O)O
Complexity: 175
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AB69053
ChemicalName:
5-Borononicotinic acid
CasNumber:
913836-03-0
MolecularFormula:
C6H6BNO4
MolecularWeight:
166.92713999999998
MdlNumber:
MFCD02323212
Smiles:
OB(c1cncc(c1)C(=O)O)O
Complexity:
175
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@@H]1[C@@H](COP(=O)(OP(=O)([O-])[O-])[O-])O[C@H]([C@@H]1O)n1ccc(nc1=O)N.[Na+].[Na+].[Na+]
Complexity: 671
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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ChemicalName:
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MolecularFormula:
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MolecularWeight:
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Smiles:
O[C@@H]1[C@@H](COP(=O)(OP(=O)([O-])[O-])[O-])O[C@H]([C@@H]1O)n1ccc(nc1=O)N.[Na+].[Na+].[Na+]
Complexity:
671
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: Clc1cccc2n1cnn2
Complexity: __
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Smiles:
Clc1cccc2n1cnn2
Complexity:
__
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HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Clc1cc2cccnc2c2c1cccn2
Complexity: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Clc1cc2cccnc2c2c1cccn2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__