AB62759
90905-31-0 | 2-(Methylthio)pyrimidine-5-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB62759
ChemicalName
2-(Methylthio)pyrimidine-5-carbaldehyde
CasNumber
90905-31-0
MolecularFormula
C6H6N2OS
MolecularWeight
154.1896
MdlNumber
MFCD03780729
Smiles
CSc1ncc(cn1)C=O
Complexity
112
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
0.5
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CatalogNumber: AB62759
ChemicalName: 2-(Methylthio)pyrimidine-5-carbaldehyde
CasNumber: 90905-31-0
MolecularFormula: C6H6N2OS
MolecularWeight: 154.1896
MdlNumber: MFCD03780729
Smiles: CSc1ncc(cn1)C=O
Complexity: 112
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AB62759
ChemicalName:
2-(Methylthio)pyrimidine-5-carbaldehyde
CasNumber:
90905-31-0
MolecularFormula:
C6H6N2OS
MolecularWeight:
154.1896
MdlNumber:
MFCD03780729
Smiles:
CSc1ncc(cn1)C=O
Complexity:
112
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: AB62760
ChemicalName: 2-(Methylsulfonyl)-1-phenylethanone
CasNumber: 3708-04-1
MolecularFormula: C9H10O3S
MolecularWeight: 198.2389
MdlNumber: MFCD00025078
Smiles: O=C(c1ccccc1)CS(=O)(=O)C
Complexity: 268
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AB62760
ChemicalName:
2-(Methylsulfonyl)-1-phenylethanone
CasNumber:
3708-04-1
MolecularFormula:
C9H10O3S
MolecularWeight:
198.2389
MdlNumber:
MFCD00025078
Smiles:
O=C(c1ccccc1)CS(=O)(=O)C
Complexity:
268
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1
CatalogNumber: AB62761
ChemicalName: 2-Methylsulfonylthiophene
CasNumber: 38695-60-2
MolecularFormula: C5H6O2S2
MolecularWeight: 162.2299
MdlNumber: MFCD00052826
Smiles: CS(=O)(=O)c1cccs1
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 0.4
CatalogNumber:
AB62761
ChemicalName:
2-Methylsulfonylthiophene
CasNumber:
38695-60-2
MolecularFormula:
C5H6O2S2
MolecularWeight:
162.2299
MdlNumber:
MFCD00052826
Smiles:
CS(=O)(=O)c1cccs1
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
0.4
CatalogNumber: AB62762
ChemicalName: 2-Methyl-tetrahydro-furan-2-carboxylic acid
CasNumber: 61449-65-8
MolecularFormula: C6H10O3
MolecularWeight: 130.1418
MdlNumber: MFCD04039310
Smiles: OC(=O)C1(C)CCCO1
Complexity: 132
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 0.4
CatalogNumber:
AB62762
ChemicalName:
2-Methyl-tetrahydro-furan-2-carboxylic acid
CasNumber:
61449-65-8
MolecularFormula:
C6H10O3
MolecularWeight:
130.1418
MdlNumber:
MFCD04039310
Smiles:
OC(=O)C1(C)CCCO1
Complexity:
132
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
0.4