AA54636
1218790-98-7 | 4-(1-Carboxycyclopropyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA54636
ChemicalName
4-(1-Carboxycyclopropyl)phenylboronic acid, pinacol ester
CasNumber
1218790-98-7
MolecularFormula
C16H21BO4
MolecularWeight
288.1465
MdlNumber
MFCD09037838
Smiles
OC(=O)C1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
418
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AA54636
ChemicalName: 4-(1-Carboxycyclopropyl)phenylboronic acid, pinacol ester
CasNumber: 1218790-98-7
MolecularFormula: C16H21BO4
MolecularWeight: 288.1465
MdlNumber: MFCD09037838
Smiles: OC(=O)C1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 418
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AA54636
ChemicalName:
4-(1-Carboxycyclopropyl)phenylboronic acid, pinacol ester
CasNumber:
1218790-98-7
MolecularFormula:
C16H21BO4
MolecularWeight:
288.1465
MdlNumber:
MFCD09037838
Smiles:
OC(=O)C1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
418
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1cc2c([nH]1)cc(cc2)OCc1ccccc1)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1cc2c([nH]1)cc(cc2)OCc1ccccc1)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA54638
ChemicalName: 2-Butylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber: 1218791-48-0
MolecularFormula: C14H24BN3O2
MolecularWeight: 277.1703
MdlNumber: MFCD12546558
Smiles: CCCCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: 302
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 5
CatalogNumber:
AA54638
ChemicalName:
2-Butylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber:
1218791-48-0
MolecularFormula:
C14H24BN3O2
MolecularWeight:
277.1703
MdlNumber:
MFCD12546558
Smiles:
CCCCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
302
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
5
CatalogNumber: AA54639
ChemicalName: 2-Propylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber: 1218791-47-9
MolecularFormula: C13H22BN3O2
MolecularWeight: 263.1437
MdlNumber: MFCD12546557
Smiles: CCCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: 288
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
CatalogNumber:
AA54639
ChemicalName:
2-Propylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber:
1218791-47-9
MolecularFormula:
C13H22BN3O2
MolecularWeight:
263.1437
MdlNumber:
MFCD12546557
Smiles:
CCCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
288
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4