AB52781
1189127-05-6 | B-(3-Ethynylphenyl)-boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AB52781
ChemicalName
B-(3-Ethynylphenyl)-boronic acid
CasNumber
1189127-05-6
MolecularFormula
C8H7BO2
MolecularWeight
145.951
MdlNumber
MFCD17677372
Smiles
C#Cc1cccc(c1)B(O)O
Complexity
170
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AB52781
ChemicalName: B-(3-Ethynylphenyl)-boronic acid
CasNumber: 1189127-05-6
MolecularFormula: C8H7BO2
MolecularWeight: 145.951
MdlNumber: MFCD17677372
Smiles: C#Cc1cccc(c1)B(O)O
Complexity: 170
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AB52781
ChemicalName:
B-(3-Ethynylphenyl)-boronic acid
CasNumber:
1189127-05-6
MolecularFormula:
C8H7BO2
MolecularWeight:
145.951
MdlNumber:
MFCD17677372
Smiles:
C#Cc1cccc(c1)B(O)O
Complexity:
170
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: COC(=O)c1ccc2c(c1)cc([nH]2)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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MolecularFormula:
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Smiles:
COC(=O)c1ccc2c(c1)cc([nH]2)C(=O)O
Complexity:
__
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__
HeavyAtomCount:
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Smiles: CCCCCC1=CC(=CC2NC(=CC2=O)c2ccc[nH]2)N=C1C
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Smiles:
CCCCCC1=CC(=CC2NC(=CC2=O)c2ccc[nH]2)N=C1C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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RotatableBondCount:
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Smiles: OC(=O)CC[C@@H](C(=O)O)N.N
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HeavyAtomCount: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)CC[C@@H](C(=O)O)N.N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__