AC19267
850567-50-9 | 3-Amino-5-methoxycarbonylphenylboronic acid, pinacol ester, HCl
Manufacturer: A2B Chem
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CatalogNumber
AC19267
ChemicalName
3-Amino-5-methoxycarbonylphenylboronic acid, pinacol ester, HCl
CasNumber
850567-50-9
MolecularFormula
C14H21BClNO4
MolecularWeight
313.5848
MdlNumber
MFCD06659919
Smiles
COC(=O)c1cc(cc(c1)N)B1OC(C(O1)(C)C)(C)C.Cl
Complexity
369
Covalently-bondedUnitCount
2
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AC19267
ChemicalName: 3-Amino-5-methoxycarbonylphenylboronic acid, pinacol ester, HCl
CasNumber: 850567-50-9
MolecularFormula: C14H21BClNO4
MolecularWeight: 313.5848
MdlNumber: MFCD06659919
Smiles: COC(=O)c1cc(cc(c1)N)B1OC(C(O1)(C)C)(C)C.Cl
Complexity: 369
Covalently-bondedUnitCount: 2
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AC19267
ChemicalName:
3-Amino-5-methoxycarbonylphenylboronic acid, pinacol ester, HCl
CasNumber:
850567-50-9
MolecularFormula:
C14H21BClNO4
MolecularWeight:
313.5848
MdlNumber:
MFCD06659919
Smiles:
COC(=O)c1cc(cc(c1)N)B1OC(C(O1)(C)C)(C)C.Cl
Complexity:
369
Covalently-bondedUnitCount:
2
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1cccc(c1)B1OCC(CO1)(C)C)NC1CCCC1
Complexity: 385
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1cccc(c1)B1OCC(CO1)(C)C)NC1CCCC1
Complexity:
385
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AC19269
ChemicalName: N-(3-Bromopropyl) 3-boronobenzamide
CasNumber: 850567-42-9
MolecularFormula: C10H13BBrNO3
MolecularWeight: 285.9301
MdlNumber: MFCD06659892
Smiles: BrCCCNC(=O)c1cccc(c1)B(O)O
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 5
CatalogNumber:
AC19269
ChemicalName:
N-(3-Bromopropyl) 3-boronobenzamide
CasNumber:
850567-42-9
MolecularFormula:
C10H13BBrNO3
MolecularWeight:
285.9301
MdlNumber:
MFCD06659892
Smiles:
BrCCCNC(=O)c1cccc(c1)B(O)O
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
5
CatalogNumber: AC19270
ChemicalName: N-(3-Bromopropyl) 4-Boronobenzamide
CasNumber: 850567-41-8
MolecularFormula: C10H13BBrNO3
MolecularWeight: 285.9301
MdlNumber: MFCD06659891
Smiles: BrCCCNC(=O)c1ccc(cc1)B(O)O
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 5
CatalogNumber:
AC19270
ChemicalName:
N-(3-Bromopropyl) 4-Boronobenzamide
CasNumber:
850567-41-8
MolecularFormula:
C10H13BBrNO3
MolecularWeight:
285.9301
MdlNumber:
MFCD06659891
Smiles:
BrCCCNC(=O)c1ccc(cc1)B(O)O
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
5