AB60913
22720-75-8 | 2-Acetylbenzothiophene
Manufacturer: A2B Chem
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CatalogNumber
AB60913
ChemicalName
2-Acetylbenzothiophene
CasNumber
22720-75-8
MolecularFormula
C10H8OS
MolecularWeight
176.23492000000002
MdlNumber
MFCD00090217
Smiles
CC(=O)c1cc2c(s1)cccc2
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
3
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CatalogNumber: AB60913
ChemicalName: 2-Acetylbenzothiophene
CasNumber: 22720-75-8
MolecularFormula: C10H8OS
MolecularWeight: 176.23492000000002
MdlNumber: MFCD00090217
Smiles: CC(=O)c1cc2c(s1)cccc2
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AB60913
ChemicalName:
2-Acetylbenzothiophene
CasNumber:
22720-75-8
MolecularFormula:
C10H8OS
MolecularWeight:
176.23492000000002
MdlNumber:
MFCD00090217
Smiles:
CC(=O)c1cc2c(s1)cccc2
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
3
CatalogNumber: AB60914
ChemicalName: 2-Acetylbenzoic acid
CasNumber: 577-56-0
MolecularFormula: C9H8O3
MolecularWeight: 164.15802
MdlNumber: MFCD00002475
Smiles: OC(=O)c1ccccc1C(=O)C
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AB60914
ChemicalName:
2-Acetylbenzoic acid
CasNumber:
577-56-0
MolecularFormula:
C9H8O3
MolecularWeight:
164.15802
MdlNumber:
MFCD00002475
Smiles:
OC(=O)c1ccccc1C(=O)C
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C32
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C32
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)C1CCCC1=O
Complexity: 149
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)C1CCCC1=O
Complexity:
149
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.3