AA72959
1450-85-7 | 2-Mercaptopyrimidine
Manufacturer: A2B Chem
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CatalogNumber
AA72959
ChemicalName
2-Mercaptopyrimidine
CasNumber
1450-85-7
MolecularFormula
C4H4N2S
MolecularWeight
112.153
MdlNumber
MFCD00006073
Smiles
S=c1nccc[nH]1
Complexity
137
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
Xlogp3
-1.1
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CatalogNumber: AA72959
ChemicalName: 2-Mercaptopyrimidine
CasNumber: 1450-85-7
MolecularFormula: C4H4N2S
MolecularWeight: 112.153
MdlNumber: MFCD00006073
Smiles: S=c1nccc[nH]1
Complexity: 137
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
Xlogp3: -1.1
CatalogNumber:
AA72959
ChemicalName:
2-Mercaptopyrimidine
CasNumber:
1450-85-7
MolecularFormula:
C4H4N2S
MolecularWeight:
112.153
MdlNumber:
MFCD00006073
Smiles:
S=c1nccc[nH]1
Complexity:
137
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
Xlogp3:
-1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(CCCBr)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(CCCBr)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: AA72961
ChemicalName: 2'-Hydroxy-5'-nitroacetophenone
CasNumber: 1450-76-6
MolecularFormula: C8H7NO4
MolecularWeight: 181.1455
MdlNumber: MFCD00463816
Smiles: [O-][N+](=O)c1ccc(c(c1)C(=O)C)O
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: 1.8
CatalogNumber:
AA72961
ChemicalName:
2'-Hydroxy-5'-nitroacetophenone
CasNumber:
1450-76-6
MolecularFormula:
C8H7NO4
MolecularWeight:
181.1455
MdlNumber:
MFCD00463816
Smiles:
[O-][N+](=O)c1ccc(c(c1)C(=O)C)O
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
1.8
CatalogNumber: AA72962
ChemicalName: 1-(5-Bromo-2-hydroxyphenyl)ethanone
CasNumber: 1450-75-5
MolecularFormula: C8H7BrO2
MolecularWeight: 215.04397999999998
MdlNumber: MFCD00191850
Smiles: Brc1ccc(c(c1)C(=O)C)O
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
Xlogp3: 2.7
CatalogNumber:
AA72962
ChemicalName:
1-(5-Bromo-2-hydroxyphenyl)ethanone
CasNumber:
1450-75-5
MolecularFormula:
C8H7BrO2
MolecularWeight:
215.04397999999998
MdlNumber:
MFCD00191850
Smiles:
Brc1ccc(c(c1)C(=O)C)O
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
Xlogp3:
2.7