AX55343
2096333-95-6 | 2-(Methanesulfonyl(N-methoxymethyl)amino)pyrimidine-5-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AX55343
ChemicalName
2-(Methanesulfonyl(N-methoxymethyl)amino)pyrimidine-5-boronic acid, pinacol ester
CasNumber
2096333-95-6
MolecularFormula
C13H22BN3O5S
MolecularWeight
343.2069
MdlNumber
MFCD19684127
Smiles
COCN(S(=O)(=O)C)c1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity
498
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
8
RotatableBondCount
5
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CatalogNumber: AX55343
ChemicalName: 2-(Methanesulfonyl(N-methoxymethyl)amino)pyrimidine-5-boronic acid, pinacol ester
CasNumber: 2096333-95-6
MolecularFormula: C13H22BN3O5S
MolecularWeight: 343.2069
MdlNumber: MFCD19684127
Smiles: COCN(S(=O)(=O)C)c1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: 498
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 8
RotatableBondCount: 5
CatalogNumber:
AX55343
ChemicalName:
2-(Methanesulfonyl(N-methoxymethyl)amino)pyrimidine-5-boronic acid, pinacol ester
CasNumber:
2096333-95-6
MolecularFormula:
C13H22BN3O5S
MolecularWeight:
343.2069
MdlNumber:
MFCD19684127
Smiles:
COCN(S(=O)(=O)C)c1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
498
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
8
RotatableBondCount:
5
CatalogNumber: AX55344
ChemicalName: 4-Chloro-3-(methoxycarbonyl)-5-methylphenylboronic acid, pinacol ester
CasNumber: 2096330-10-6
MolecularFormula: C15H20BClO4
MolecularWeight: 310.5809
MdlNumber: MFCD18914528
Smiles: COC(=O)c1cc(cc(c1Cl)C)B1OC(C(O1)(C)C)(C)C
Complexity: 397
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AX55344
ChemicalName:
4-Chloro-3-(methoxycarbonyl)-5-methylphenylboronic acid, pinacol ester
CasNumber:
2096330-10-6
MolecularFormula:
C15H20BClO4
MolecularWeight:
310.5809
MdlNumber:
MFCD18914528
Smiles:
COC(=O)c1cc(cc(c1Cl)C)B1OC(C(O1)(C)C)(C)C
Complexity:
397
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)C)F
Complexity: 397
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)C)F
Complexity:
397
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55346
ChemicalName: 3-Ethoxy-2-fluoro-5-methylphenylboronic acid
CasNumber: 2096333-49-0
MolecularFormula: C9H12BFO3
MolecularWeight: 197.9992
MdlNumber: MFCD19981525
Smiles: CCOc1cc(C)cc(c1F)B(O)O
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AX55346
ChemicalName:
3-Ethoxy-2-fluoro-5-methylphenylboronic acid
CasNumber:
2096333-49-0
MolecularFormula:
C9H12BFO3
MolecularWeight:
197.9992
MdlNumber:
MFCD19981525
Smiles:
CCOc1cc(C)cc(c1F)B(O)O
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3