AF70876
402-10-8 | 3-Bromo-4-methoxybenzotrifluoride
Manufacturer: A2B Chem
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CatalogNumber
AF70876
ChemicalName
3-Bromo-4-methoxybenzotrifluoride
CasNumber
402-10-8
MolecularFormula
C8H6BrF3O
MolecularWeight
255.0318
MdlNumber
MFCD03789249
Smiles
COc1ccc(cc1Br)C(F)(F)F
Complexity
171
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
3.5
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CatalogNumber: AF70876
ChemicalName: 3-Bromo-4-methoxybenzotrifluoride
CasNumber: 402-10-8
MolecularFormula: C8H6BrF3O
MolecularWeight: 255.0318
MdlNumber: MFCD03789249
Smiles: COc1ccc(cc1Br)C(F)(F)F
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AF70876
ChemicalName:
3-Bromo-4-methoxybenzotrifluoride
CasNumber:
402-10-8
MolecularFormula:
C8H6BrF3O
MolecularWeight:
255.0318
MdlNumber:
MFCD03789249
Smiles:
COc1ccc(cc1Br)C(F)(F)F
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
3.5
CatalogNumber: AF70877
ChemicalName: 4-Bromo-1-chloro-2-(trifluoromethoxy)benzene
CasNumber: 406232-79-9
MolecularFormula: C7H3BrClF3O
MolecularWeight: 275.4503
MdlNumber: MFCD09878140
Smiles: FC(Oc1cc(Br)ccc1Cl)(F)F
Complexity: 176
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 4.4
CatalogNumber:
AF70877
ChemicalName:
4-Bromo-1-chloro-2-(trifluoromethoxy)benzene
CasNumber:
406232-79-9
MolecularFormula:
C7H3BrClF3O
MolecularWeight:
275.4503
MdlNumber:
MFCD09878140
Smiles:
FC(Oc1cc(Br)ccc1Cl)(F)F
Complexity:
176
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
4.4
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Smiles: NNC(=O)c1cccc(c1)n1cnnn1
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Smiles:
NNC(=O)c1cccc(c1)n1cnnn1
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Smiles: CCSc1ccc(cc1)N
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Smiles:
CCSc1ccc(cc1)N
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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