AI49004
365564-12-1 | 3-methylbenzylboronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI49004
ChemicalName
3-methylbenzylboronic acid pinacol ester
CasNumber
365564-12-1
MolecularFormula
C14H21BO2
MolecularWeight
232.1263
MdlNumber
MFCD23102598
Smiles
Cc1cccc(c1)CB1OC(C(O1)(C)C)(C)C
Complexity
259
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
2
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CatalogNumber: AI49004
ChemicalName: 3-methylbenzylboronic acid pinacol ester
CasNumber: 365564-12-1
MolecularFormula: C14H21BO2
MolecularWeight: 232.1263
MdlNumber: MFCD23102598
Smiles: Cc1cccc(c1)CB1OC(C(O1)(C)C)(C)C
Complexity: 259
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
CatalogNumber:
AI49004
ChemicalName:
3-methylbenzylboronic acid pinacol ester
CasNumber:
365564-12-1
MolecularFormula:
C14H21BO2
MolecularWeight:
232.1263
MdlNumber:
MFCD23102598
Smiles:
Cc1cccc(c1)CB1OC(C(O1)(C)C)(C)C
Complexity:
259
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
CatalogNumber: AI49005
ChemicalName: tert-Butyl 2-bromo-6,7-dihydrothiazolo[5,4-c]pyridine-5(4H)-carboxylate
CasNumber: 365996-06-1
MolecularFormula: C11H15BrN2O2S
MolecularWeight: 319.218
MdlNumber: MFCD09951958
Smiles: O=C(N1CCc2c(C1)sc(n2)Br)OC(C)(C)C
Complexity: 308
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
CatalogNumber:
AI49005
ChemicalName:
tert-Butyl 2-bromo-6,7-dihydrothiazolo[5,4-c]pyridine-5(4H)-carboxylate
CasNumber:
365996-06-1
MolecularFormula:
C11H15BrN2O2S
MolecularWeight:
319.218
MdlNumber:
MFCD09951958
Smiles:
O=C(N1CCc2c(C1)sc(n2)Br)OC(C)(C)C
Complexity:
308
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
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Smiles: Nc1sc2c(n1)CN(C2)C(=O)OC(C)(C)C
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Smiles:
Nc1sc2c(n1)CN(C2)C(=O)OC(C)(C)C
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Smiles: Brc1sc2c(n1)CN(C2)C(=O)OC(C)(C)C
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MolecularFormula:
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Smiles:
Brc1sc2c(n1)CN(C2)C(=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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