AB75638
63484-12-8 | Methyl 2-methoxy-5-(methylsulfonyl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AB75638
ChemicalName
Methyl 2-methoxy-5-(methylsulfonyl)benzoate
CasNumber
63484-12-8
MolecularFormula
C10H12O5S
MolecularWeight
244.2643
MdlNumber
MFCD01317545
Smiles
COC(=O)c1cc(ccc1OC)S(=O)(=O)C
Complexity
343
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
0.7
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CatalogNumber: AB75638
ChemicalName: Methyl 2-methoxy-5-(methylsulfonyl)benzoate
CasNumber: 63484-12-8
MolecularFormula: C10H12O5S
MolecularWeight: 244.2643
MdlNumber: MFCD01317545
Smiles: COC(=O)c1cc(ccc1OC)S(=O)(=O)C
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 0.7
CatalogNumber:
AB75638
ChemicalName:
Methyl 2-methoxy-5-(methylsulfonyl)benzoate
CasNumber:
63484-12-8
MolecularFormula:
C10H12O5S
MolecularWeight:
244.2643
MdlNumber:
MFCD01317545
Smiles:
COC(=O)c1cc(ccc1OC)S(=O)(=O)C
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
0.7
CatalogNumber: AB75639
ChemicalName: Methyl 2-methoxy-5-nitrobenzoate
CasNumber: 34841-11-7
MolecularFormula: C9H9NO5
MolecularWeight: 211.1715
MdlNumber: MFCD00673023
Smiles: COC(=O)c1cc(ccc1OC)[N+](=O)[O-]
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AB75639
ChemicalName:
Methyl 2-methoxy-5-nitrobenzoate
CasNumber:
34841-11-7
MolecularFormula:
C9H9NO5
MolecularWeight:
211.1715
MdlNumber:
MFCD00673023
Smiles:
COC(=O)c1cc(ccc1OC)[N+](=O)[O-]
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(ccc1OC)S(=O)(=O)N
Complexity: 347
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(ccc1OC)S(=O)(=O)N
Complexity:
347
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1c(OC)cccc1[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1c(OC)cccc1[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__