AE82047
1514-11-0 | 4-bromo-1-methoxy-2-(trifluoromethyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AE82047
ChemicalName
4-bromo-1-methoxy-2-(trifluoromethyl)benzene
CasNumber
1514-11-0
MolecularFormula
C8H6BrF3O
MolecularWeight
255.0318
MdlNumber
MFCD01631579
Smiles
COc1ccc(cc1C(F)(F)F)Br
Complexity
171
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
3.5
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CatalogNumber: AE82047
ChemicalName: 4-bromo-1-methoxy-2-(trifluoromethyl)benzene
CasNumber: 1514-11-0
MolecularFormula: C8H6BrF3O
MolecularWeight: 255.0318
MdlNumber: MFCD01631579
Smiles: COc1ccc(cc1C(F)(F)F)Br
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AE82047
ChemicalName:
4-bromo-1-methoxy-2-(trifluoromethyl)benzene
CasNumber:
1514-11-0
MolecularFormula:
C8H6BrF3O
MolecularWeight:
255.0318
MdlNumber:
MFCD01631579
Smiles:
COc1ccc(cc1C(F)(F)F)Br
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC(=CC=C1C(=O)N=N)N2C(=CC=C2O)O.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1=CC(=CC=C1C(=O)N=N)N2C(=CC=C2O)O.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE82049
ChemicalName: Ethyl 4-chloro-8-iodoquinoline-3-carboxylate
CasNumber: 193975-33-6
MolecularFormula: C12H9ClINO2
MolecularWeight: 361.5628
MdlNumber: MFCD09991531
Smiles: CCOC(=O)c1cnc2c(c1Cl)cccc2I
Complexity: 290
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AE82049
ChemicalName:
Ethyl 4-chloro-8-iodoquinoline-3-carboxylate
CasNumber:
193975-33-6
MolecularFormula:
C12H9ClINO2
MolecularWeight:
361.5628
MdlNumber:
MFCD09991531
Smiles:
CCOC(=O)c1cnc2c(c1Cl)cccc2I
Complexity:
290
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.7
CatalogNumber: AE82050
ChemicalName: 5-Bromo-2-(hydroxymethyl)phenol
CasNumber: 170434-11-4
MolecularFormula: C7H7BrO2
MolecularWeight: 203.0333
MdlNumber: MFCD08445665
Smiles: OCc1ccc(cc1O)Br
Complexity: 108
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AE82050
ChemicalName:
5-Bromo-2-(hydroxymethyl)phenol
CasNumber:
170434-11-4
MolecularFormula:
C7H7BrO2
MolecularWeight:
203.0333
MdlNumber:
MFCD08445665
Smiles:
OCc1ccc(cc1O)Br
Complexity:
108
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.9