AG29533
478375-39-2 | 3-(Methoxycarbonyl)-4-methylphenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AG29533
ChemicalName
3-(Methoxycarbonyl)-4-methylphenylboronic acid, pinacol ester
CasNumber
478375-39-2
MolecularFormula
C15H21BO4
MolecularWeight
276.1358
MdlNumber
MFCD16996355
Smiles
COC(=O)c1cc(ccc1C)B1OC(C(O1)(C)C)(C)C
Complexity
364
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
RotatableBondCount
3
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CatalogNumber: AG29533
ChemicalName: 3-(Methoxycarbonyl)-4-methylphenylboronic acid, pinacol ester
CasNumber: 478375-39-2
MolecularFormula: C15H21BO4
MolecularWeight: 276.1358
MdlNumber: MFCD16996355
Smiles: COC(=O)c1cc(ccc1C)B1OC(C(O1)(C)C)(C)C
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AG29533
ChemicalName:
3-(Methoxycarbonyl)-4-methylphenylboronic acid, pinacol ester
CasNumber:
478375-39-2
MolecularFormula:
C15H21BO4
MolecularWeight:
276.1358
MdlNumber:
MFCD16996355
Smiles:
COC(=O)c1cc(ccc1C)B1OC(C(O1)(C)C)(C)C
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cnc(c(n1)C(=O)O)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Cc1cnc(c(n1)C(=O)O)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AG29535
ChemicalName: Methyl 3-bromo-4-(trifluoromethyl)benzoate
CasNumber: 455941-82-9
MolecularFormula: C9H6BrF3O2
MolecularWeight: 283.0419
MdlNumber: MFCD14697998
Smiles: COC(=O)c1ccc(c(c1)Br)C(F)(F)F
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
CatalogNumber:
AG29535
ChemicalName:
Methyl 3-bromo-4-(trifluoromethyl)benzoate
CasNumber:
455941-82-9
MolecularFormula:
C9H6BrF3O2
MolecularWeight:
283.0419
MdlNumber:
MFCD14697998
Smiles:
COC(=O)c1ccc(c(c1)Br)C(F)(F)F
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1nc[nH]c1N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1nc[nH]c1N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__