AC61569
80-41-1 | 2-Chloroethyl p-toluenesulfonate
Manufacturer: A2B Chem
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CatalogNumber
AC61569
ChemicalName
2-Chloroethyl p-toluenesulfonate
CasNumber
80-41-1
MolecularFormula
C9H11ClO3S
MolecularWeight
234.6998
MdlNumber
MFCD00000970
Smiles
ClCCOS(=O)(=O)c1ccc(cc1)C
NscNumber
6079
Complexity
250
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
2
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CatalogNumber: AC61569
ChemicalName: 2-Chloroethyl p-toluenesulfonate
CasNumber: 80-41-1
MolecularFormula: C9H11ClO3S
MolecularWeight: 234.6998
MdlNumber: MFCD00000970
Smiles: ClCCOS(=O)(=O)c1ccc(cc1)C
NscNumber: 6079
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 2
CatalogNumber:
AC61569
ChemicalName:
2-Chloroethyl p-toluenesulfonate
CasNumber:
80-41-1
MolecularFormula:
C9H11ClO3S
MolecularWeight:
234.6998
MdlNumber:
MFCD00000970
Smiles:
ClCCOS(=O)(=O)c1ccc(cc1)C
NscNumber:
6079
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(C=O)ccc1[N+](=O)[O-]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(C=O)ccc1[N+](=O)[O-]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AC61573
ChemicalName: 4-(2-Methoxyethoxy)benzonitrile
CasNumber: 80407-66-5
MolecularFormula: C10H11NO2
MolecularWeight: 177.1998
MdlNumber: MFCD09907643
Smiles: COCCOc1ccc(cc1)C#N
NscNumber: __
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 1.4
CatalogNumber:
AC61573
ChemicalName:
4-(2-Methoxyethoxy)benzonitrile
CasNumber:
80407-66-5
MolecularFormula:
C10H11NO2
MolecularWeight:
177.1998
MdlNumber:
MFCD09907643
Smiles:
COCCOc1ccc(cc1)C#N
NscNumber:
__
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCCCCCC(C(=O)OCC1COCCOCCOCCO1)(C(=O)OCC1COCCOCCOCCO1)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCCCCCCC(C(=O)OCC1COCCOCCOCCO1)(C(=O)OCC1COCCOCCOCCO1)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__