AE16572
1040281-86-4 | 4-(Methoxycarbonyl)thiophene-2-boronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AE16572
ChemicalName
4-(Methoxycarbonyl)thiophene-2-boronic acid pinacol ester
CasNumber
1040281-86-4
MolecularFormula
C12H17BO4S
MolecularWeight
268.137
MdlNumber
MFCD12407258
Smiles
COC(=O)c1csc(c1)B1OC(C(O1)(C)C)(C)C
Complexity
329
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
RotatableBondCount
3
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CatalogNumber: AE16572
ChemicalName: 4-(Methoxycarbonyl)thiophene-2-boronic acid pinacol ester
CasNumber: 1040281-86-4
MolecularFormula: C12H17BO4S
MolecularWeight: 268.137
MdlNumber: MFCD12407258
Smiles: COC(=O)c1csc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 329
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
CatalogNumber:
AE16572
ChemicalName:
4-(Methoxycarbonyl)thiophene-2-boronic acid pinacol ester
CasNumber:
1040281-86-4
MolecularFormula:
C12H17BO4S
MolecularWeight:
268.137
MdlNumber:
MFCD12407258
Smiles:
COC(=O)c1csc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
329
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
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Smiles: O=C(N1CCc2c(CC1)c(Cl)nc(n2)Cl)OC(C)(C)C
Complexity: __
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Smiles:
O=C(N1CCc2c(CC1)c(Cl)nc(n2)Cl)OC(C)(C)C
Complexity:
__
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Smiles: N#CC1CNCCN1C(=O)OC(C)(C)C
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Smiles:
N#CC1CNCCN1C(=O)OC(C)(C)C
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: O=C(/C=C/c1ccc(cc1)C(F)(F)F)/C=C/c1ccc(cc1)C(F)(F)F
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(/C=C/c1ccc(cc1)C(F)(F)F)/C=C/c1ccc(cc1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__