AD37942
170230-88-3 | 5-Carboxy-2-methylphenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AD37942
ChemicalName
5-Carboxy-2-methylphenylboronic acid
CasNumber
170230-88-3
MolecularFormula
C8H9BO4
MolecularWeight
179.96566
MdlNumber
MFCD08061639
Smiles
OB(c1cc(ccc1C)C(=O)O)O
Complexity
195
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AD37942
ChemicalName: 5-Carboxy-2-methylphenylboronic acid
CasNumber: 170230-88-3
MolecularFormula: C8H9BO4
MolecularWeight: 179.96566
MdlNumber: MFCD08061639
Smiles: OB(c1cc(ccc1C)C(=O)O)O
Complexity: 195
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AD37942
ChemicalName:
5-Carboxy-2-methylphenylboronic acid
CasNumber:
170230-88-3
MolecularFormula:
C8H9BO4
MolecularWeight:
179.96566
MdlNumber:
MFCD08061639
Smiles:
OB(c1cc(ccc1C)C(=O)O)O
Complexity:
195
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: COc1ccc(cc1)C(=O)N(c1ccccc1)Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
COc1ccc(cc1)C(=O)N(c1ccccc1)Cc1ccccc1
Complexity:
__
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HeavyAtomCount:
__
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Smiles: NC(=N)NCCC[C@@H](C(=O)N[C@H](C(=O)N)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)N)CCCNC(=N)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
NC(=N)NCCC[C@@H](C(=O)N[C@H](C(=O)N)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)N)CCCNC(=N)N
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=Cc1cc(=O)n2c3c1cccc3CCC2
Complexity: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
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ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=Cc1cc(=O)n2c3c1cccc3CCC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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