AX55436
2096338-43-9 | 5-(cyclopropylaminomethyl)-2-fluorophenylboronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AX55436
ChemicalName
5-(cyclopropylaminomethyl)-2-fluorophenylboronic acid pinacol ester
CasNumber
2096338-43-9
MolecularFormula
C16H23BFNO2
MolecularWeight
291.1687
MdlNumber
MFCD18434459
Smiles
Fc1ccc(cc1B1OC(C(O1)(C)C)(C)C)CNC1CC1
Complexity
371
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
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CatalogNumber: AX55436
ChemicalName: 5-(cyclopropylaminomethyl)-2-fluorophenylboronic acid pinacol ester
CasNumber: 2096338-43-9
MolecularFormula: C16H23BFNO2
MolecularWeight: 291.1687
MdlNumber: MFCD18434459
Smiles: Fc1ccc(cc1B1OC(C(O1)(C)C)(C)C)CNC1CC1
Complexity: 371
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
CatalogNumber:
AX55436
ChemicalName:
5-(cyclopropylaminomethyl)-2-fluorophenylboronic acid pinacol ester
CasNumber:
2096338-43-9
MolecularFormula:
C16H23BFNO2
MolecularWeight:
291.1687
MdlNumber:
MFCD18434459
Smiles:
Fc1ccc(cc1B1OC(C(O1)(C)C)(C)C)CNC1CC1
Complexity:
371
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
CatalogNumber: AX55437
ChemicalName: 2,3-Dichloro-4-ethoxyphenylboronic acid
CasNumber: 2096341-64-7
MolecularFormula: C8H9BCl2O3
MolecularWeight: 234.8723
MdlNumber: MFCD21609523
Smiles: CCOc1ccc(c(c1Cl)Cl)B(O)O
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55437
ChemicalName:
2,3-Dichloro-4-ethoxyphenylboronic acid
CasNumber:
2096341-64-7
MolecularFormula:
C8H9BCl2O3
MolecularWeight:
234.8723
MdlNumber:
MFCD21609523
Smiles:
CCOc1ccc(c(c1Cl)Cl)B(O)O
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AX55439
ChemicalName: 5-Bromo-2-fluoro-4-(methoxycarbonyl)phenylboronic acid, pinacol ester
CasNumber: 2096331-46-1
MolecularFormula: C14H17BBrFO4
MolecularWeight: 358.9958
MdlNumber: MFCD18837629
Smiles: COC(=O)c1cc(F)c(cc1Br)B1OC(C(O1)(C)C)(C)C
Complexity: 402
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 3
CatalogNumber:
AX55439
ChemicalName:
5-Bromo-2-fluoro-4-(methoxycarbonyl)phenylboronic acid, pinacol ester
CasNumber:
2096331-46-1
MolecularFormula:
C14H17BBrFO4
MolecularWeight:
358.9958
MdlNumber:
MFCD18837629
Smiles:
COC(=O)c1cc(F)c(cc1Br)B1OC(C(O1)(C)C)(C)C
Complexity:
402
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cnc(c(c1)B(O)O)OC1CCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Cc1cnc(c(c1)B(O)O)OC1CCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__