AF36952
2976-33-2 | 1-(Ethanesulfonyl)-2-nitrobenzene
Manufacturer: A2B Chem
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CatalogNumber
AF36952
ChemicalName
1-(Ethanesulfonyl)-2-nitrobenzene
CasNumber
2976-33-2
MolecularFormula
C8H9NO4S
MolecularWeight
215.2264
MdlNumber
MFCD24448798
Smiles
CCS(=O)(=O)c1ccccc1[N+](=O)[O-]
Complexity
300
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AF36952
ChemicalName: 1-(Ethanesulfonyl)-2-nitrobenzene
CasNumber: 2976-33-2
MolecularFormula: C8H9NO4S
MolecularWeight: 215.2264
MdlNumber: MFCD24448798
Smiles: CCS(=O)(=O)c1ccccc1[N+](=O)[O-]
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AF36952
ChemicalName:
1-(Ethanesulfonyl)-2-nitrobenzene
CasNumber:
2976-33-2
MolecularFormula:
C8H9NO4S
MolecularWeight:
215.2264
MdlNumber:
MFCD24448798
Smiles:
CCS(=O)(=O)c1ccccc1[N+](=O)[O-]
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: AF36953
ChemicalName: 1,4-Dioxaspiro[4.5]decan-8-yl 4-methylbenzenesulfonate
CasNumber: 23511-05-9
MolecularFormula: C15H20O5S
MolecularWeight: 312.3813
MdlNumber: MFCD18429461
Smiles: Cc1ccc(cc1)S(=O)(=O)OC1CCC2(CC1)OCCO2
Complexity: 431
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AF36953
ChemicalName:
1,4-Dioxaspiro[4.5]decan-8-yl 4-methylbenzenesulfonate
CasNumber:
23511-05-9
MolecularFormula:
C15H20O5S
MolecularWeight:
312.3813
MdlNumber:
MFCD18429461
Smiles:
Cc1ccc(cc1)S(=O)(=O)OC1CCC2(CC1)OCCO2
Complexity:
431
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=N)NCCC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=N)NCCC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF36955
ChemicalName: 4-(Adamantan-1-yl)phenyl trifluoromethanesulfonate
CasNumber: 263398-16-9
MolecularFormula: C17H19F3O3S
MolecularWeight: 360.3912
MdlNumber: MFCD24448806
Smiles: FC(S(=O)(=O)Oc1ccc(cc1)C12CC3CC(C2)CC(C1)C3)(F)F
Complexity: 544
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 6
RotatableBondCount: 3
Xlogp3: 6.1
CatalogNumber:
AF36955
ChemicalName:
4-(Adamantan-1-yl)phenyl trifluoromethanesulfonate
CasNumber:
263398-16-9
MolecularFormula:
C17H19F3O3S
MolecularWeight:
360.3912
MdlNumber:
MFCD24448806
Smiles:
FC(S(=O)(=O)Oc1ccc(cc1)C12CC3CC(C2)CC(C1)C3)(F)F
Complexity:
544
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
6
RotatableBondCount:
3
Xlogp3:
6.1