AX55168
2096339-62-5 | 4-(Ethoxycarbonyl)-2-methylphenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX55168
ChemicalName
4-(Ethoxycarbonyl)-2-methylphenylboronic acid
CasNumber
2096339-62-5
MolecularFormula
C10H13BO4
MolecularWeight
208.0188
MdlNumber
MFCD21332941
Smiles
CCOC(=O)c1ccc(c(c1)C)B(O)O
Complexity
220
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AX55168
ChemicalName: 4-(Ethoxycarbonyl)-2-methylphenylboronic acid
CasNumber: 2096339-62-5
MolecularFormula: C10H13BO4
MolecularWeight: 208.0188
MdlNumber: MFCD21332941
Smiles: CCOC(=O)c1ccc(c(c1)C)B(O)O
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55168
ChemicalName:
4-(Ethoxycarbonyl)-2-methylphenylboronic acid
CasNumber:
2096339-62-5
MolecularFormula:
C10H13BO4
MolecularWeight:
208.0188
MdlNumber:
MFCD21332941
Smiles:
CCOC(=O)c1ccc(c(c1)C)B(O)O
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AX55169
ChemicalName: 4-Cyano-3-isopropoxyphenylboronic acid
CasNumber: 2096339-85-2
MolecularFormula: C10H12BNO3
MolecularWeight: 205.0182
MdlNumber: MFCD19684098
Smiles: N#Cc1ccc(cc1OC(C)C)B(O)O
Complexity: 248
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55169
ChemicalName:
4-Cyano-3-isopropoxyphenylboronic acid
CasNumber:
2096339-85-2
MolecularFormula:
C10H12BNO3
MolecularWeight:
205.0182
MdlNumber:
MFCD19684098
Smiles:
N#Cc1ccc(cc1OC(C)C)B(O)O
Complexity:
248
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AX55171
ChemicalName: 4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester, HCl
CasNumber: 2096340-36-0
MolecularFormula: C17H29BClNO2
MolecularWeight: 325.6817
MdlNumber: MFCD19237204
Smiles: CCN(Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)CC.Cl
Complexity: 318
Covalently-bondedUnitCount: 2
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
CatalogNumber:
AX55171
ChemicalName:
4-(N,N-Diethylaminomethyl)phenylboronic acid, pinacol ester, HCl
CasNumber:
2096340-36-0
MolecularFormula:
C17H29BClNO2
MolecularWeight:
325.6817
MdlNumber:
MFCD19237204
Smiles:
CCN(Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)CC.Cl
Complexity:
318
Covalently-bondedUnitCount:
2
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
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Smiles: OB(c1ccc(nc1F)OCC(C)C)O
Complexity: __
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Smiles:
OB(c1ccc(nc1F)OCC(C)C)O
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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