AB62312
104048-92-2 | 4-(Trifluoromethyl)pyrimidin-2(1h)-one
Manufacturer: A2B Chem
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CatalogNumber
AB62312
ChemicalName
4-(Trifluoromethyl)pyrimidin-2(1h)-one
CasNumber
104048-92-2
MolecularFormula
C5H3F3N2O
MolecularWeight
164.0853
MdlNumber
MFCD00192529
Smiles
O=c1[nH]ccc(n1)C(F)(F)F
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
Xlogp3
-0.9
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CatalogNumber: AB62312
ChemicalName: 4-(Trifluoromethyl)pyrimidin-2(1h)-one
CasNumber: 104048-92-2
MolecularFormula: C5H3F3N2O
MolecularWeight: 164.0853
MdlNumber: MFCD00192529
Smiles: O=c1[nH]ccc(n1)C(F)(F)F
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: -0.9
CatalogNumber:
AB62312
ChemicalName:
4-(Trifluoromethyl)pyrimidin-2(1h)-one
CasNumber:
104048-92-2
MolecularFormula:
C5H3F3N2O
MolecularWeight:
164.0853
MdlNumber:
MFCD00192529
Smiles:
O=c1[nH]ccc(n1)C(F)(F)F
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
-0.9
CatalogNumber: AB62313
ChemicalName: 2-Hydroxy-4,5-dimethoxybenzaldehyde
CasNumber: 14382-91-3
MolecularFormula: C9H10O4
MolecularWeight: 182.1733
MdlNumber: MFCD00598182
Smiles: COc1cc(C=O)c(cc1OC)O
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: 1.5
CatalogNumber:
AB62313
ChemicalName:
2-Hydroxy-4,5-dimethoxybenzaldehyde
CasNumber:
14382-91-3
MolecularFormula:
C9H10O4
MolecularWeight:
182.1733
MdlNumber:
MFCD00598182
Smiles:
COc1cc(C=O)c(cc1OC)O
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
1.5
CatalogNumber: AB62314
ChemicalName: 2'-Hydroxy-4',5'-dimethylacetophenone
CasNumber: 36436-65-4
MolecularFormula: C10H12O2
MolecularWeight: 164.20108
MdlNumber: MFCD00002306
Smiles: CC(=O)c1cc(C)c(cc1O)C
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
Xlogp3: 2.5
CatalogNumber:
AB62314
ChemicalName:
2'-Hydroxy-4',5'-dimethylacetophenone
CasNumber:
36436-65-4
MolecularFormula:
C10H12O2
MolecularWeight:
164.20108
MdlNumber:
MFCD00002306
Smiles:
CC(=O)c1cc(C)c(cc1O)C
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
Xlogp3:
2.5
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Smiles: COc1cc(OC)cc(c1C(=O)C)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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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:
COc1cc(OC)cc(c1C(=O)C)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Xlogp3:
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