AB64711
433926-46-6 | 3-Chloro-5-(trifluoromethoxy)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB64711
ChemicalName
3-Chloro-5-(trifluoromethoxy)benzoic acid
CasNumber
433926-46-6
MolecularFormula
C8H4ClF3O3
MolecularWeight
240.5638
MdlNumber
MFCD06660306
Smiles
Clc1cc(cc(c1)C(=O)O)OC(F)(F)F
Complexity
244
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AB64711
ChemicalName: 3-Chloro-5-(trifluoromethoxy)benzoic acid
CasNumber: 433926-46-6
MolecularFormula: C8H4ClF3O3
MolecularWeight: 240.5638
MdlNumber: MFCD06660306
Smiles: Clc1cc(cc(c1)C(=O)O)OC(F)(F)F
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AB64711
ChemicalName:
3-Chloro-5-(trifluoromethoxy)benzoic acid
CasNumber:
433926-46-6
MolecularFormula:
C8H4ClF3O3
MolecularWeight:
240.5638
MdlNumber:
MFCD06660306
Smiles:
Clc1cc(cc(c1)C(=O)O)OC(F)(F)F
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCc1cc(cc(c1)Cl)OC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1cc(cc(c1)Cl)OC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB64713
ChemicalName: 5-Chloro-3-cyanobenzotrifluoride
CasNumber: 693245-52-2
MolecularFormula: C8H3ClF3N
MolecularWeight: 205.5643
MdlNumber: MFCD04115854
Smiles: N#Cc1cc(Cl)cc(c1)C(F)(F)F
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
AB64713
ChemicalName:
5-Chloro-3-cyanobenzotrifluoride
CasNumber:
693245-52-2
MolecularFormula:
C8H3ClF3N
MolecularWeight:
205.5643
MdlNumber:
MFCD04115854
Smiles:
N#Cc1cc(Cl)cc(c1)C(F)(F)F
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCc1cc(Cl)cc(c1)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1cc(Cl)cc(c1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__