AI62208
93-08-3 | 2-Acetylnaphthalene
Manufacturer: A2B Chem
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CatalogNumber
AI62208
ChemicalName
2-Acetylnaphthalene
CasNumber
93-08-3
MolecularFormula
C12H10O
MolecularWeight
170.2072
MdlNumber
MFCD00004108
Smiles
CC(=O)c1ccc2c(c1)cccc2
NscNumber
7658
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
3.2
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CatalogNumber: AI62208
ChemicalName: 2-Acetylnaphthalene
CasNumber: 93-08-3
MolecularFormula: C12H10O
MolecularWeight: 170.2072
MdlNumber: MFCD00004108
Smiles: CC(=O)c1ccc2c(c1)cccc2
NscNumber: 7658
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 3.2
CatalogNumber:
AI62208
ChemicalName:
2-Acetylnaphthalene
CasNumber:
93-08-3
MolecularFormula:
C12H10O
MolecularWeight:
170.2072
MdlNumber:
MFCD00004108
Smiles:
CC(=O)c1ccc2c(c1)cccc2
NscNumber:
7658
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O]C(=O)C1=NC2=[C][C]=[C][C]=C2[C]=[C]1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O]C(=O)C1=NC2=[C][C]=[C][C]=C2[C]=[C]1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClS(=O)(=O)c1ccc2c(c1)cccc2
NscNumber: __
Complexity: 294
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClS(=O)(=O)c1ccc2c(c1)cccc2
NscNumber:
__
Complexity:
294
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9
CatalogNumber: AI62211
ChemicalName: 5,6,7,8-Tetrahydronaphthalene-2-sulfonic acid
CasNumber: 93-12-9
MolecularFormula: C10H12O3S
MolecularWeight: 212.2655
MdlNumber: MFCD21963037
Smiles: OS(=O)(=O)c1ccc2c(c1)CCCC2
NscNumber: __
Complexity: 291
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AI62211
ChemicalName:
5,6,7,8-Tetrahydronaphthalene-2-sulfonic acid
CasNumber:
93-12-9
MolecularFormula:
C10H12O3S
MolecularWeight:
212.2655
MdlNumber:
MFCD21963037
Smiles:
OS(=O)(=O)c1ccc2c(c1)CCCC2
NscNumber:
__
Complexity:
291
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2