AA92391
17408-14-9 | 2'-(Trifluoromethyl)acetophenone
Manufacturer: A2B Chem
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CatalogNumber
AA92391
ChemicalName
2'-(Trifluoromethyl)acetophenone
CasNumber
17408-14-9
MolecularFormula
C9H7F3O
MolecularWeight
188.1465
MdlNumber
MFCD00000378
Smiles
CC(=O)c1ccccc1C(F)(F)F
Complexity
198
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
2.5
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CatalogNumber: AA92391
ChemicalName: 2'-(Trifluoromethyl)acetophenone
CasNumber: 17408-14-9
MolecularFormula: C9H7F3O
MolecularWeight: 188.1465
MdlNumber: MFCD00000378
Smiles: CC(=O)c1ccccc1C(F)(F)F
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AA92391
ChemicalName:
2'-(Trifluoromethyl)acetophenone
CasNumber:
17408-14-9
MolecularFormula:
C9H7F3O
MolecularWeight:
188.1465
MdlNumber:
MFCD00000378
Smiles:
CC(=O)c1ccccc1C(F)(F)F
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClS(=O)(=O)c1ccc2c(c1)cc1c(c2)cccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClS(=O)(=O)c1ccc2c(c1)cc1c(c2)cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA92395
ChemicalName: D-Alpha-hydroxyisovaleric acid
CasNumber: 17407-56-6
MolecularFormula: C5H10O3
MolecularWeight: 118.1311
MdlNumber: MFCD00066442
Smiles: O[C@@H](C(=O)O)C(C)C
Complexity: 87.7
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AA92395
ChemicalName:
D-Alpha-hydroxyisovaleric acid
CasNumber:
17407-56-6
MolecularFormula:
C5H10O3
MolecularWeight:
118.1311
MdlNumber:
MFCD00066442
Smiles:
O[C@@H](C(=O)O)C(C)C
Complexity:
87.7
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(Cc1ccccn1)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(Cc1ccccn1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__