AI46224
269409-71-4 | 4-methoxy-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI46224
ChemicalName
4-methoxy-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
CasNumber
269409-71-4
MolecularFormula
C14H19BO5
MolecularWeight
278.1087
MdlNumber
MFCD22414462
Smiles
COc1ccc(cc1B1OC(C(O1)(C)C)(C)C)C(=O)O
Complexity
366
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AI46224
ChemicalName: 4-methoxy-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
CasNumber: 269409-71-4
MolecularFormula: C14H19BO5
MolecularWeight: 278.1087
MdlNumber: MFCD22414462
Smiles: COc1ccc(cc1B1OC(C(O1)(C)C)(C)C)C(=O)O
Complexity: 366
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AI46224
ChemicalName:
4-methoxy-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
CasNumber:
269409-71-4
MolecularFormula:
C14H19BO5
MolecularWeight:
278.1087
MdlNumber:
MFCD22414462
Smiles:
COc1ccc(cc1B1OC(C(O1)(C)C)(C)C)C(=O)O
Complexity:
366
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: B1(OC(C(O1)(C)C)(C)C)C2=CC(=NC(=N2)OC)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
B1(OC(C(O1)(C)C)(C)C)C2=CC(=NC(=N2)OC)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
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