AC98089
937796-10-6 | 2-Pyrrolidin-1-ylpyrimidine-5-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AC98089
ChemicalName
2-Pyrrolidin-1-ylpyrimidine-5-carbaldehyde
CasNumber
937796-10-6
MolecularFormula
C9H11N3O
MolecularWeight
177.2031
MdlNumber
MFCD09863239
Smiles
O=Cc1cnc(nc1)N1CCCC1
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
0.6
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CatalogNumber: AC98089
ChemicalName: 2-Pyrrolidin-1-ylpyrimidine-5-carbaldehyde
CasNumber: 937796-10-6
MolecularFormula: C9H11N3O
MolecularWeight: 177.2031
MdlNumber: MFCD09863239
Smiles: O=Cc1cnc(nc1)N1CCCC1
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.6
CatalogNumber:
AC98089
ChemicalName:
2-Pyrrolidin-1-ylpyrimidine-5-carbaldehyde
CasNumber:
937796-10-6
MolecularFormula:
C9H11N3O
MolecularWeight:
177.2031
MdlNumber:
MFCD09863239
Smiles:
O=Cc1cnc(nc1)N1CCCC1
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.6
CatalogNumber: AC98090
ChemicalName: 4-(3,5-Dimethylpyrazol-1-yl)phenylboronic acid, pinacol ester
CasNumber: 937796-06-0
MolecularFormula: C17H23BN2O2
MolecularWeight: 298.1877
MdlNumber: MFCD09879979
Smiles: Cc1cc(n(n1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 392
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AC98090
ChemicalName:
4-(3,5-Dimethylpyrazol-1-yl)phenylboronic acid, pinacol ester
CasNumber:
937796-06-0
MolecularFormula:
C17H23BN2O2
MolecularWeight:
298.1877
MdlNumber:
MFCD09879979
Smiles:
Cc1cc(n(n1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
392
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CNCc1ccc(cc1)c1sccc1Br
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CNCc1ccc(cc1)c1sccc1Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: CC(=O)c1ccc(cc1)c1sccc1Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)c1ccc(cc1)c1sccc1Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__