AA54525
1218789-98-0 | 2-(Aminocarbonylmethyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA54525
ChemicalName
2-(Aminocarbonylmethyl)phenylboronic acid, pinacol ester
CasNumber
1218789-98-0
MolecularFormula
C14H20BNO3
MolecularWeight
261.1245
MdlNumber
MFCD12913986
Smiles
NC(=O)Cc1ccccc1B1OC(C(O1)(C)C)(C)C
Complexity
341
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AA54525
ChemicalName: 2-(Aminocarbonylmethyl)phenylboronic acid, pinacol ester
CasNumber: 1218789-98-0
MolecularFormula: C14H20BNO3
MolecularWeight: 261.1245
MdlNumber: MFCD12913986
Smiles: NC(=O)Cc1ccccc1B1OC(C(O1)(C)C)(C)C
Complexity: 341
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AA54525
ChemicalName:
2-(Aminocarbonylmethyl)phenylboronic acid, pinacol ester
CasNumber:
1218789-98-0
MolecularFormula:
C14H20BNO3
MolecularWeight:
261.1245
MdlNumber:
MFCD12913986
Smiles:
NC(=O)Cc1ccccc1B1OC(C(O1)(C)C)(C)C
Complexity:
341
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: AA54526
ChemicalName: 3-Acetamido-4-carboxyphenylboronic acid, pinacol ester
CasNumber: 1218789-96-8
MolecularFormula: C15H20BNO5
MolecularWeight: 305.134
MdlNumber: MFCD13195757
Smiles: CC(=O)Nc1cc(ccc1C(=O)O)B1OC(C(O1)(C)C)(C)C
Complexity: 449
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AA54526
ChemicalName:
3-Acetamido-4-carboxyphenylboronic acid, pinacol ester
CasNumber:
1218789-96-8
MolecularFormula:
C15H20BNO5
MolecularWeight:
305.134
MdlNumber:
MFCD13195757
Smiles:
CC(=O)Nc1cc(ccc1C(=O)O)B1OC(C(O1)(C)C)(C)C
Complexity:
449
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AA54527
ChemicalName: 2-Ethyl-4-methylthiazole-5-boronic acid, pinacol ester
CasNumber: 1218789-94-6
MolecularFormula: C12H20BNO2S
MolecularWeight: 253.1687
MdlNumber: MFCD12913984
Smiles: CCc1nc(c(s1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 282
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
CatalogNumber:
AA54527
ChemicalName:
2-Ethyl-4-methylthiazole-5-boronic acid, pinacol ester
CasNumber:
1218789-94-6
MolecularFormula:
C12H20BNO2S
MolecularWeight:
253.1687
MdlNumber:
MFCD12913984
Smiles:
CCc1nc(c(s1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
282
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
CatalogNumber: AA54528
ChemicalName: 5-Acetamido-2-chlorophenylboronic acid, pinacol ester
CasNumber: 1218789-92-4
MolecularFormula: C14H19BClNO3
MolecularWeight: 295.5696
MdlNumber: MFCD15143594
Smiles: CC(=O)Nc1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)Cl
Complexity: 373
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AA54528
ChemicalName:
5-Acetamido-2-chlorophenylboronic acid, pinacol ester
CasNumber:
1218789-92-4
MolecularFormula:
C14H19BClNO3
MolecularWeight:
295.5696
MdlNumber:
MFCD15143594
Smiles:
CC(=O)Nc1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)Cl
Complexity:
373
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2