AB64822
54585-47-6 | 4,6-Dimethyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB64822
ChemicalName
4,6-Dimethyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile
CasNumber
54585-47-6
MolecularFormula
C8H8N2S
MolecularWeight
164.2275
MdlNumber
MFCD00051684
Smiles
Cc1cc(C)[nH]c(=S)c1C#N
Complexity
314
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
Xlogp3
1
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CatalogNumber: AB64822
ChemicalName: 4,6-Dimethyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile
CasNumber: 54585-47-6
MolecularFormula: C8H8N2S
MolecularWeight: 164.2275
MdlNumber: MFCD00051684
Smiles: Cc1cc(C)[nH]c(=S)c1C#N
Complexity: 314
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
Xlogp3: 1
CatalogNumber:
AB64822
ChemicalName:
4,6-Dimethyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile
CasNumber:
54585-47-6
MolecularFormula:
C8H8N2S
MolecularWeight:
164.2275
MdlNumber:
MFCD00051684
Smiles:
Cc1cc(C)[nH]c(=S)c1C#N
Complexity:
314
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
Xlogp3:
1
CatalogNumber: AB64823
ChemicalName: 3-Cyano-4-fluorobenzenesulfonyl chloride
CasNumber: 351003-23-1
MolecularFormula: C7H3ClFNO2S
MolecularWeight: 219.62062320000004
MdlNumber: MFCD03093760
Smiles: N#Cc1cc(ccc1F)S(=O)(=O)Cl
Complexity: 328
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
Xlogp3: 1.8
CatalogNumber:
AB64823
ChemicalName:
3-Cyano-4-fluorobenzenesulfonyl chloride
CasNumber:
351003-23-1
MolecularFormula:
C7H3ClFNO2S
MolecularWeight:
219.62062320000004
MdlNumber:
MFCD03093760
Smiles:
N#Cc1cc(ccc1F)S(=O)(=O)Cl
Complexity:
328
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
Xlogp3:
1.8
CatalogNumber: AB64824
ChemicalName: 2-Hydroxy-4-methylpyridine-3-carbonitrile
CasNumber: 93271-59-1
MolecularFormula: C7H6N2O
MolecularWeight: 134.1353
MdlNumber: MFCD00716620
Smiles: N#Cc1c(C)cc[nH]c1=O
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
Xlogp3: 0.1
CatalogNumber:
AB64824
ChemicalName:
2-Hydroxy-4-methylpyridine-3-carbonitrile
CasNumber:
93271-59-1
MolecularFormula:
C7H6N2O
MolecularWeight:
134.1353
MdlNumber:
MFCD00716620
Smiles:
N#Cc1c(C)cc[nH]c1=O
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
Xlogp3:
0.1
CatalogNumber: AB64825
ChemicalName: 3-Cyanopyridine-4-boronic acid pinacol ester
CasNumber: 878194-92-4
MolecularFormula: C12H15BN2O2
MolecularWeight: 230.0707
MdlNumber: MFCD00152510
Smiles: N#Cc1cnccc1B1OC(C(O1)(C)C)(C)C
Complexity: 332
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
AB64825
ChemicalName:
3-Cyanopyridine-4-boronic acid pinacol ester
CasNumber:
878194-92-4
MolecularFormula:
C12H15BN2O2
MolecularWeight:
230.0707
MdlNumber:
MFCD00152510
Smiles:
N#Cc1cnccc1B1OC(C(O1)(C)C)(C)C
Complexity:
332
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
Xlogp3:
__