AE25250
1191999-09-3 | 1-(2-Fluoro-3-hydroxyphenyl)ethanone
Manufacturer: A2B Chem
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CatalogNumber
AE25250
ChemicalName
1-(2-Fluoro-3-hydroxyphenyl)ethanone
CasNumber
1191999-09-3
MolecularFormula
C8H7FO2
MolecularWeight
154.1384
MdlNumber
MFCD13190055
Smiles
CC(=O)c1cccc(c1F)O
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.4
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CatalogNumber: AE25250
ChemicalName: 1-(2-Fluoro-3-hydroxyphenyl)ethanone
CasNumber: 1191999-09-3
MolecularFormula: C8H7FO2
MolecularWeight: 154.1384
MdlNumber: MFCD13190055
Smiles: CC(=O)c1cccc(c1F)O
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.4
CatalogNumber:
AE25250
ChemicalName:
1-(2-Fluoro-3-hydroxyphenyl)ethanone
CasNumber:
1191999-09-3
MolecularFormula:
C8H7FO2
MolecularWeight:
154.1384
MdlNumber:
MFCD13190055
Smiles:
CC(=O)c1cccc(c1F)O
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1ccc(cc1)CCN(C(=O)OC(C)(C)C)C)O
Complexity: 309
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1ccc(cc1)CCN(C(=O)OC(C)(C)C)C)O
Complexity:
309
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCN(CC1)CC(=O)O)OC(C)(C)C.O.O
Complexity: 290
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCN(CC1)CC(=O)O)OC(C)(C)C.O.O
Complexity:
290
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE25253
ChemicalName: 2-Chloro-1-methanesulfonyl-4-(trifluoromethyl)benzene
CasNumber: 1000339-68-3
MolecularFormula: C8H6ClF3O2S
MolecularWeight: 258.6452
MdlNumber: MFCD09264544
Smiles: Clc1cc(ccc1S(=O)(=O)C)C(F)(F)F
Complexity: 320
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AE25253
ChemicalName:
2-Chloro-1-methanesulfonyl-4-(trifluoromethyl)benzene
CasNumber:
1000339-68-3
MolecularFormula:
C8H6ClF3O2S
MolecularWeight:
258.6452
MdlNumber:
MFCD09264544
Smiles:
Clc1cc(ccc1S(=O)(=O)C)C(F)(F)F
Complexity:
320
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.7