AC78443
957035-27-7 | 4-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine
Manufacturer: A2B Chem
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CatalogNumber
AC78443
ChemicalName
4-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine
CasNumber
957035-27-7
MolecularFormula
C7H4ClIN4
MolecularWeight
306.4909
MdlNumber
MFCD09475879
Smiles
Ic1cnn(c1)c1ncnc(c1)Cl
Complexity
182
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AC78443
ChemicalName: 4-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine
CasNumber: 957035-27-7
MolecularFormula: C7H4ClIN4
MolecularWeight: 306.4909
MdlNumber: MFCD09475879
Smiles: Ic1cnn(c1)c1ncnc(c1)Cl
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AC78443
ChemicalName:
4-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine
CasNumber:
957035-27-7
MolecularFormula:
C7H4ClIN4
MolecularWeight:
306.4909
MdlNumber:
MFCD09475879
Smiles:
Ic1cnn(c1)c1ncnc(c1)Cl
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccc(cc1Cl)B(O)O)NC1CCCCC1
Complexity: 310
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccc(cc1Cl)B(O)O)NC1CCCCC1
Complexity:
310
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AC78445
ChemicalName: 4-Fluoro-3-(2,2,2-trifluoroethoxy)phenylboronic acid
CasNumber: 957034-62-7
MolecularFormula: C8H7BF4O3
MolecularWeight: 237.944
MdlNumber: MFCD09475813
Smiles: OB(c1ccc(c(c1)OCC(F)(F)F)F)O
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AC78445
ChemicalName:
4-Fluoro-3-(2,2,2-trifluoroethoxy)phenylboronic acid
CasNumber:
957034-62-7
MolecularFormula:
C8H7BF4O3
MolecularWeight:
237.944
MdlNumber:
MFCD09475813
Smiles:
OB(c1ccc(c(c1)OCC(F)(F)F)F)O
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1ccc(cc1)c1nnc(s1)N)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1ccc(cc1)c1nnc(s1)N)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__