AI46228
269410-24-4 | Indole-5-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI46228
ChemicalName
Indole-5-boronic acid, pinacol ester
CasNumber
269410-24-4
MolecularFormula
C14H18BNO2
MolecularWeight
243.1092
MdlNumber
MFCD03789263
Smiles
CC1(C)OB(OC1(C)C)c1ccc2c(c1)cc[nH]2
Complexity
316
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
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CatalogNumber: AI46228
ChemicalName: Indole-5-boronic acid, pinacol ester
CasNumber: 269410-24-4
MolecularFormula: C14H18BNO2
MolecularWeight: 243.1092
MdlNumber: MFCD03789263
Smiles: CC1(C)OB(OC1(C)C)c1ccc2c(c1)cc[nH]2
Complexity: 316
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
CatalogNumber:
AI46228
ChemicalName:
Indole-5-boronic acid, pinacol ester
CasNumber:
269410-24-4
MolecularFormula:
C14H18BNO2
MolecularWeight:
243.1092
MdlNumber:
MFCD03789263
Smiles:
CC1(C)OB(OC1(C)C)c1ccc2c(c1)cc[nH]2
Complexity:
316
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC1=NC(n2c(N1)nc1c2cccc1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
NC1=NC(n2c(N1)nc1c2cccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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CatalogNumber: AI46231
ChemicalName: 4-(N-methylacetamido)benzoic acid
CasNumber: 26961-99-9
MolecularFormula: C10H11NO3
MolecularWeight: 193.1992
MdlNumber: MFCD20542852
Smiles: CN(c1ccc(cc1)C(=O)O)C(=O)C
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AI46231
ChemicalName:
4-(N-methylacetamido)benzoic acid
CasNumber:
26961-99-9
MolecularFormula:
C10H11NO3
MolecularWeight:
193.1992
MdlNumber:
MFCD20542852
Smiles:
CN(c1ccc(cc1)C(=O)O)C(=O)C
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(=O)c2c(o1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COc1cc(=O)c2c(o1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__