AA50508
1373232-67-7 | 1,2-Dimethanesulfonylpyrrole
Manufacturer: A2B Chem
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CatalogNumber
AA50508
ChemicalName
1,2-Dimethanesulfonylpyrrole
CasNumber
1373232-67-7
MolecularFormula
C6H9NO4S2
MolecularWeight
223.27
MdlNumber
MFCD22192476
Smiles
CS(=O)(=O)n1cccc1S(=O)(=O)C
Complexity
372
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
-0.1
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CatalogNumber: AA50508
ChemicalName: 1,2-Dimethanesulfonylpyrrole
CasNumber: 1373232-67-7
MolecularFormula: C6H9NO4S2
MolecularWeight: 223.27
MdlNumber: MFCD22192476
Smiles: CS(=O)(=O)n1cccc1S(=O)(=O)C
Complexity: 372
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: -0.1
CatalogNumber:
AA50508
ChemicalName:
1,2-Dimethanesulfonylpyrrole
CasNumber:
1373232-67-7
MolecularFormula:
C6H9NO4S2
MolecularWeight:
223.27
MdlNumber:
MFCD22192476
Smiles:
CS(=O)(=O)n1cccc1S(=O)(=O)C
Complexity:
372
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
-0.1
CatalogNumber: AA50509
ChemicalName: 4-Fluoro-3-(4-nitrophenyl)toluene
CasNumber: 1373232-66-6
MolecularFormula: C13H10FNO2
MolecularWeight: 231.2224
MdlNumber: MFCD22192483
Smiles: Cc1ccc(c(c1)c1ccc(cc1)[N+](=O)[O-])F
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 3.8
CatalogNumber:
AA50509
ChemicalName:
4-Fluoro-3-(4-nitrophenyl)toluene
CasNumber:
1373232-66-6
MolecularFormula:
C13H10FNO2
MolecularWeight:
231.2224
MdlNumber:
MFCD22192483
Smiles:
Cc1ccc(c(c1)c1ccc(cc1)[N+](=O)[O-])F
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
3.8
CatalogNumber: AA50510
ChemicalName: 2-Nitro-5-(trifluoromethoxy)benzamide
CasNumber: 1373232-62-2
MolecularFormula: C8H5F3N2O4
MolecularWeight: 250.1315
MdlNumber: MFCD22192357
Smiles: NC(=O)c1cc(ccc1[N+](=O)[O-])OC(F)(F)F
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 7
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AA50510
ChemicalName:
2-Nitro-5-(trifluoromethoxy)benzamide
CasNumber:
1373232-62-2
MolecularFormula:
C8H5F3N2O4
MolecularWeight:
250.1315
MdlNumber:
MFCD22192357
Smiles:
NC(=O)c1cc(ccc1[N+](=O)[O-])OC(F)(F)F
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
7
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: AA50511
ChemicalName: 5-Amino-3-(trifluoromethyl)pyridin-2-ol
CasNumber: 1373232-58-6
MolecularFormula: C6H5F3N2O
MolecularWeight: 178.11190959999996
MdlNumber: MFCD23726507
Smiles: FC(c1cc(N)c[nH]c1=O)(F)F
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
RotatableBondCount: __
Xlogp3: 0.1
CatalogNumber:
AA50511
ChemicalName:
5-Amino-3-(trifluoromethyl)pyridin-2-ol
CasNumber:
1373232-58-6
MolecularFormula:
C6H5F3N2O
MolecularWeight:
178.11190959999996
MdlNumber:
MFCD23726507
Smiles:
FC(c1cc(N)c[nH]c1=O)(F)F
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
RotatableBondCount:
__
Xlogp3:
0.1