AA50506
1373232-69-9 | Methyl 3-(5-methoxypyridin-3-yl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AA50506
ChemicalName
Methyl 3-(5-methoxypyridin-3-yl)benzoate
CasNumber
1373232-69-9
MolecularFormula
C14H13NO3
MolecularWeight
243.2579
MdlNumber
MFCD22192484
Smiles
COc1cncc(c1)c1cccc(c1)C(=O)OC
Complexity
282
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
2.3
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CatalogNumber: AA50506
ChemicalName: Methyl 3-(5-methoxypyridin-3-yl)benzoate
CasNumber: 1373232-69-9
MolecularFormula: C14H13NO3
MolecularWeight: 243.2579
MdlNumber: MFCD22192484
Smiles: COc1cncc(c1)c1cccc(c1)C(=O)OC
Complexity: 282
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.3
CatalogNumber:
AA50506
ChemicalName:
Methyl 3-(5-methoxypyridin-3-yl)benzoate
CasNumber:
1373232-69-9
MolecularFormula:
C14H13NO3
MolecularWeight:
243.2579
MdlNumber:
MFCD22192484
Smiles:
COc1cncc(c1)c1cccc(c1)C(=O)OC
Complexity:
282
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc(cc1)c1cccc(c1)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccc(cc1)c1cccc(c1)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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