AD31450
196083-20-2 | [6-(2,2,2-Trifluoroethoxy)pyridin-3-yl]boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AD31450
ChemicalName
[6-(2,2,2-Trifluoroethoxy)pyridin-3-yl]boronic acid
CasNumber
196083-20-2
MolecularFormula
C7H7BF3NO3
MolecularWeight
220.9416
MdlNumber
MFCD07374889
Smiles
OB(c1ccc(nc1)OCC(F)(F)F)O
Complexity
202
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AD31450
ChemicalName: [6-(2,2,2-Trifluoroethoxy)pyridin-3-yl]boronic acid
CasNumber: 196083-20-2
MolecularFormula: C7H7BF3NO3
MolecularWeight: 220.9416
MdlNumber: MFCD07374889
Smiles: OB(c1ccc(nc1)OCC(F)(F)F)O
Complexity: 202
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AD31450
ChemicalName:
[6-(2,2,2-Trifluoroethoxy)pyridin-3-yl]boronic acid
CasNumber:
196083-20-2
MolecularFormula:
C7H7BF3NO3
MolecularWeight:
220.9416
MdlNumber:
MFCD07374889
Smiles:
OB(c1ccc(nc1)OCC(F)(F)F)O
Complexity:
202
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
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CasNumber: __
MolecularFormula: __
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Smiles: N[C@H]([C@H](C[C@H](Cc1ccccc1)NC(=O)[C@@H](N1CCCNC1=O)C(C)C)O)Cc1ccccc1.O=C1CC[C@H](N1)C(=O)O
Complexity: __
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Smiles:
N[C@H]([C@H](C[C@H](Cc1ccccc1)NC(=O)[C@@H](N1CCCNC1=O)C(C)C)O)Cc1ccccc1.O=C1CC[C@H](N1)C(=O)O
Complexity:
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Smiles: O=C(NC([C@H](CC(NC(=O)[C@@H](N1CCC(=O)NC1=O)C(C)C)Cc1ccccc1)O)Cc1ccccc1)COc1c(C)cccc1C
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Smiles:
O=C(NC([C@H](CC(NC(=O)[C@@H](N1CCC(=O)NC1=O)C(C)C)Cc1ccccc1)O)Cc1ccccc1)COc1c(C)cccc1C
Complexity:
__
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: COC(=O)N1CCC(CC1)CC1Cc2c(C1=O)cc(c(c2)OC)OC
Complexity: __
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CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COC(=O)N1CCC(CC1)CC1Cc2c(C1=O)cc(c(c2)OC)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__