AB66090
713-65-5 | 1-Nitro-4-(trifluoromethoxy)benzene
Manufacturer: A2B Chem
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CatalogNumber
AB66090
ChemicalName
1-Nitro-4-(trifluoromethoxy)benzene
CasNumber
713-65-5
MolecularFormula
C7H4F3NO3
MolecularWeight
207.1068
MdlNumber
MFCD00040302
Smiles
FC(Oc1ccc(cc1)[N+](=O)[O-])(F)F
Complexity
205
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
6
RotatableBondCount
1
Xlogp3
3.2
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CatalogNumber: AB66090
ChemicalName: 1-Nitro-4-(trifluoromethoxy)benzene
CasNumber: 713-65-5
MolecularFormula: C7H4F3NO3
MolecularWeight: 207.1068
MdlNumber: MFCD00040302
Smiles: FC(Oc1ccc(cc1)[N+](=O)[O-])(F)F
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
Xlogp3: 3.2
CatalogNumber:
AB66090
ChemicalName:
1-Nitro-4-(trifluoromethoxy)benzene
CasNumber:
713-65-5
MolecularFormula:
C7H4F3NO3
MolecularWeight:
207.1068
MdlNumber:
MFCD00040302
Smiles:
FC(Oc1ccc(cc1)[N+](=O)[O-])(F)F
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
Xlogp3:
3.2
CatalogNumber: AB66091
ChemicalName: 4-(Trifluoromethoxy)phenacyl bromide
CasNumber: 103962-10-3
MolecularFormula: C9H6BrF3O2
MolecularWeight: 283.04194960000007
MdlNumber: MFCD00052333
Smiles: BrCC(=O)c1ccc(cc1)OC(F)(F)F
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 3.6
CatalogNumber:
AB66091
ChemicalName:
4-(Trifluoromethoxy)phenacyl bromide
CasNumber:
103962-10-3
MolecularFormula:
C9H6BrF3O2
MolecularWeight:
283.04194960000007
MdlNumber:
MFCD00052333
Smiles:
BrCC(=O)c1ccc(cc1)OC(F)(F)F
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
3.6
CatalogNumber: AB66092
ChemicalName: 4-(Trifluoromethoxy)phenoxyacetic acid
CasNumber: 72220-50-9
MolecularFormula: C9H7F3O4
MolecularWeight: 236.14468960000002
MdlNumber: MFCD00052352
Smiles: OC(=O)COc1ccc(cc1)OC(F)(F)F
Complexity: 233
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
RotatableBondCount: 4
Xlogp3: 2.4
CatalogNumber:
AB66092
ChemicalName:
4-(Trifluoromethoxy)phenoxyacetic acid
CasNumber:
72220-50-9
MolecularFormula:
C9H7F3O4
MolecularWeight:
236.14468960000002
MdlNumber:
MFCD00052352
Smiles:
OC(=O)COc1ccc(cc1)OC(F)(F)F
Complexity:
233
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
RotatableBondCount:
4
Xlogp3:
2.4
CatalogNumber: AB66093
ChemicalName: 4-(Trifluoromethoxy)phenylisothiocyanate
CasNumber: 64285-95-6
MolecularFormula: C8H4F3NOS
MolecularWeight: 219.1837
MdlNumber: MFCD00042412
Smiles: S=C=Nc1ccc(cc1)OC(F)(F)F
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: 4.8
CatalogNumber:
AB66093
ChemicalName:
4-(Trifluoromethoxy)phenylisothiocyanate
CasNumber:
64285-95-6
MolecularFormula:
C8H4F3NOS
MolecularWeight:
219.1837
MdlNumber:
MFCD00042412
Smiles:
S=C=Nc1ccc(cc1)OC(F)(F)F
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
4.8