AD95144
850198-68-4 | 3-Acetyl-4-fluorophenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AD95144
ChemicalName
3-Acetyl-4-fluorophenylboronic acid
CasNumber
850198-68-4
MolecularFormula
C8H8BFO3
MolecularWeight
181.9567
MdlNumber
MFCD10696641
Smiles
OB(c1ccc(c(c1)C(=O)C)F)O
Complexity
198
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AD95144
ChemicalName: 3-Acetyl-4-fluorophenylboronic acid
CasNumber: 850198-68-4
MolecularFormula: C8H8BFO3
MolecularWeight: 181.9567
MdlNumber: MFCD10696641
Smiles: OB(c1ccc(c(c1)C(=O)C)F)O
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AD95144
ChemicalName:
3-Acetyl-4-fluorophenylboronic acid
CasNumber:
850198-68-4
MolecularFormula:
C8H8BFO3
MolecularWeight:
181.9567
MdlNumber:
MFCD10696641
Smiles:
OB(c1ccc(c(c1)C(=O)C)F)O
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
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Smiles: COS(=O)(=O)[O-].C=CC(=O)OCC(C[N+](C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
COS(=O)(=O)[O-].C=CC(=O)OCC(C[N+](C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
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RotatableBondCount:
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Smiles: OCCNCCN(CCNCCO)CCO
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Smiles:
OCCNCCN(CCNCCO)CCO
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C(c1cc(O)c(c(c1)O)Br)Nc1ccccc1N1CCCC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(c1cc(O)c(c(c1)O)Br)Nc1ccccc1N1CCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__