AG72596
6104-41-2 | 4-Methoxypyrimidine
Manufacturer: A2B Chem
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CatalogNumber
AG72596
ChemicalName
4-Methoxypyrimidine
CasNumber
6104-41-2
MolecularFormula
C5H6N2O
MolecularWeight
110.1139
MdlNumber
MFCD12405815
Smiles
COc1ccncn1
NscNumber
193519
Complexity
67.4
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
0.5
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CatalogNumber: AG72596
ChemicalName: 4-Methoxypyrimidine
CasNumber: 6104-41-2
MolecularFormula: C5H6N2O
MolecularWeight: 110.1139
MdlNumber: MFCD12405815
Smiles: COc1ccncn1
NscNumber: 193519
Complexity: 67.4
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 0.5
CatalogNumber:
AG72596
ChemicalName:
4-Methoxypyrimidine
CasNumber:
6104-41-2
MolecularFormula:
C5H6N2O
MolecularWeight:
110.1139
MdlNumber:
MFCD12405815
Smiles:
COc1ccncn1
NscNumber:
193519
Complexity:
67.4
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
0.5
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Smiles: CCCCC(C/C=C/[C@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C
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Complexity: __
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Xlogp3: __
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Smiles:
CCCCC(C/C=C/[C@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)OC)(O)C
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Complexity:
__
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Smiles: CN(C1C(=O)C(=C(C2(C1CC1C(=C(O)c3c(C1(C)O)cccc3O)C2=O)O)O)C(=O)C)C
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Smiles:
CN(C1C(=O)C(=C(C2(C1CC1C(=C(O)c3c(C1(C)O)cccc3O)C2=O)O)O)C(=O)C)C
NscNumber:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: [2H]C(N(C([2H])([2H])[2H])CCCN1c2ccccc2CCc2c1cccc2)([2H])[2H]
NscNumber: __
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[2H]C(N(C([2H])([2H])[2H])CCCN1c2ccccc2CCc2c1cccc2)([2H])[2H]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__