AI46227
269410-22-2 | 4-Hydroxy-3-methoxyphenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI46227
ChemicalName
4-Hydroxy-3-methoxyphenylboronic acid, pinacol ester
CasNumber
269410-22-2
MolecularFormula
C13H19BO4
MolecularWeight
250.09856
MdlNumber
MFCD02093723
Smiles
COc1cc(ccc1O)B1OC(C(O1)(C)C)(C)C
Complexity
289
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AI46227
ChemicalName: 4-Hydroxy-3-methoxyphenylboronic acid, pinacol ester
CasNumber: 269410-22-2
MolecularFormula: C13H19BO4
MolecularWeight: 250.09856
MdlNumber: MFCD02093723
Smiles: COc1cc(ccc1O)B1OC(C(O1)(C)C)(C)C
Complexity: 289
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AI46227
ChemicalName:
4-Hydroxy-3-methoxyphenylboronic acid, pinacol ester
CasNumber:
269410-22-2
MolecularFormula:
C13H19BO4
MolecularWeight:
250.09856
MdlNumber:
MFCD02093723
Smiles:
COc1cc(ccc1O)B1OC(C(O1)(C)C)(C)C
Complexity:
289
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
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:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC1=NC(n2c(N1)nc1c2cccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
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