AA30967
1256346-02-7 | 3-Propoxy-5-(trifluoromethoxy)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA30967
ChemicalName
3-Propoxy-5-(trifluoromethoxy)phenylboronic acid
CasNumber
1256346-02-7
MolecularFormula
C10H12BF3O4
MolecularWeight
264.0061
MdlNumber
MFCD16618933
Smiles
CCCOc1cc(cc(c1)B(O)O)OC(F)(F)F
Complexity
250
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
5
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CatalogNumber: AA30967
ChemicalName: 3-Propoxy-5-(trifluoromethoxy)phenylboronic acid
CasNumber: 1256346-02-7
MolecularFormula: C10H12BF3O4
MolecularWeight: 264.0061
MdlNumber: MFCD16618933
Smiles: CCCOc1cc(cc(c1)B(O)O)OC(F)(F)F
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AA30967
ChemicalName:
3-Propoxy-5-(trifluoromethoxy)phenylboronic acid
CasNumber:
1256346-02-7
MolecularFormula:
C10H12BF3O4
MolecularWeight:
264.0061
MdlNumber:
MFCD16618933
Smiles:
CCCOc1cc(cc(c1)B(O)O)OC(F)(F)F
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
5
CatalogNumber: AA30968
ChemicalName: 3-Isopropoxy-5-(trifluoromethoxy)phenylboronic acid
CasNumber: 1256346-01-6
MolecularFormula: C10H12BF3O4
MolecularWeight: 264.0061
MdlNumber: MFCD16295063
Smiles: CC(Oc1cc(cc(c1)B(O)O)OC(F)(F)F)C
Complexity: 260
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AA30968
ChemicalName:
3-Isopropoxy-5-(trifluoromethoxy)phenylboronic acid
CasNumber:
1256346-01-6
MolecularFormula:
C10H12BF3O4
MolecularWeight:
264.0061
MdlNumber:
MFCD16295063
Smiles:
CC(Oc1cc(cc(c1)B(O)O)OC(F)(F)F)C
Complexity:
260
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
4
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Smiles: OB(CSc1ccccn1)O
Complexity: __
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RotatableBondCount: __
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Smiles:
OB(CSc1ccccn1)O
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Nc1ncc2c(n1)CN(C2)Cc1ccccc1
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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:
Nc1ncc2c(n1)CN(C2)Cc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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