AH83710
88-20-0 | 2-Toluenesulfonic acid
Manufacturer: A2B Chem
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CatalogNumber
AH83710
ChemicalName
2-Toluenesulfonic acid
CasNumber
88-20-0
MolecularFormula
C7H8O3S
MolecularWeight
172.20162000000002
MdlNumber
MFCD00069442
Smiles
Cc1ccccc1S(=O)(=O)O
Complexity
214
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1
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CatalogNumber: AH83710
ChemicalName: 2-Toluenesulfonic acid
CasNumber: 88-20-0
MolecularFormula: C7H8O3S
MolecularWeight: 172.20162000000002
MdlNumber: MFCD00069442
Smiles: Cc1ccccc1S(=O)(=O)O
Complexity: 214
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AH83710
ChemicalName:
2-Toluenesulfonic acid
CasNumber:
88-20-0
MolecularFormula:
C7H8O3S
MolecularWeight:
172.20162000000002
MdlNumber:
MFCD00069442
Smiles:
Cc1ccccc1S(=O)(=O)O
Complexity:
214
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN(CC1CCCCC1)CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN(CC1CCCCC1)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AH83712
ChemicalName: L-Octahydroindole-2-carboxylic acid benzyl ester 4-methylbenzenesulfonate
CasNumber: 94062-52-9
MolecularFormula: C23H29NO5S
MolecularWeight: 431.5451
MdlNumber: MFCD09751101
Smiles: O=C([C@@H]1C[C@H]2[C@@H](N1)CCCC2)OCc1ccccc1.Cc1ccc(cc1)S(=O)(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AH83712
ChemicalName:
L-Octahydroindole-2-carboxylic acid benzyl ester 4-methylbenzenesulfonate
CasNumber:
94062-52-9
MolecularFormula:
C23H29NO5S
MolecularWeight:
431.5451
MdlNumber:
MFCD09751101
Smiles:
O=C([C@@H]1C[C@H]2[C@@H](N1)CCCC2)OCc1ccccc1.Cc1ccc(cc1)S(=O)(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=c1oc2-c3ccccc3S(=O)(=O)N(c2c(=O)n1c1ccccn1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=c1oc2-c3ccccc3S(=O)(=O)N(c2c(=O)n1c1ccccn1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__