AD45379
1073355-21-1 | 2-Cyano-4-(trifluoromethyl)phenylboronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AD45379
ChemicalName
2-Cyano-4-(trifluoromethyl)phenylboronic acid pinacol ester
CasNumber
1073355-21-1
MolecularFormula
C14H15BF3NO2
MolecularWeight
297.0806
MdlNumber
MFCD09878539
Smiles
N#Cc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(F)(F)F
Complexity
439
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
6
RotatableBondCount
1
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CatalogNumber: AD45379
ChemicalName: 2-Cyano-4-(trifluoromethyl)phenylboronic acid pinacol ester
CasNumber: 1073355-21-1
MolecularFormula: C14H15BF3NO2
MolecularWeight: 297.0806
MdlNumber: MFCD09878539
Smiles: N#Cc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(F)(F)F
Complexity: 439
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
CatalogNumber:
AD45379
ChemicalName:
2-Cyano-4-(trifluoromethyl)phenylboronic acid pinacol ester
CasNumber:
1073355-21-1
MolecularFormula:
C14H15BF3NO2
MolecularWeight:
297.0806
MdlNumber:
MFCD09878539
Smiles:
N#Cc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(F)(F)F
Complexity:
439
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)OB(OC1(C)C)c1cc(Cl)c(cc1F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC1(C)OB(OC1(C)C)c1cc(Cl)c(cc1F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AD45381
ChemicalName: 2-[4-(N-Boc)piperazin-1-yl]phenylboronic acid pinacol ester
CasNumber: 1073354-59-2
MolecularFormula: C21H33BN2O4
MolecularWeight: 388.3087
MdlNumber: MFCD08669542
Smiles: O=C(N1CCN(CC1)c1ccccc1B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity: 551
Covalently-bondedUnitCount: 1
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
CatalogNumber:
AD45381
ChemicalName:
2-[4-(N-Boc)piperazin-1-yl]phenylboronic acid pinacol ester
CasNumber:
1073354-59-2
MolecularFormula:
C21H33BN2O4
MolecularWeight:
388.3087
MdlNumber:
MFCD08669542
Smiles:
O=C(N1CCN(CC1)c1ccccc1B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity:
551
Covalently-bondedUnitCount:
1
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__