AD62748
187085-97-8 | 1-(3,5-Bis(trifluoromethyl)phenyl)ethanamine
Manufacturer: A2B Chem
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CatalogNumber
AD62748
ChemicalName
1-(3,5-Bis(trifluoromethyl)phenyl)ethanamine
CasNumber
187085-97-8
MolecularFormula
C10H9F6N
MolecularWeight
257.1756
MdlNumber
MFCD04038875
Smiles
CC(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)N
Complexity
237
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
2.9
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CatalogNumber: AD62748
ChemicalName: 1-(3,5-Bis(trifluoromethyl)phenyl)ethanamine
CasNumber: 187085-97-8
MolecularFormula: C10H9F6N
MolecularWeight: 257.1756
MdlNumber: MFCD04038875
Smiles: CC(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)N
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.9
CatalogNumber:
AD62748
ChemicalName:
1-(3,5-Bis(trifluoromethyl)phenyl)ethanamine
CasNumber:
187085-97-8
MolecularFormula:
C10H9F6N
MolecularWeight:
257.1756
MdlNumber:
MFCD04038875
Smiles:
CC(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)N
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1ccc(o1)CN
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1ccc(o1)CN
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AD62751
ChemicalName: 4-Bromo-6-methoxy-2-(trifluoromethyl)quinoline
CasNumber: 18706-38-2
MolecularFormula: C11H7BrF3NO
MolecularWeight: 306.0786
MdlNumber: MFCD11855898
Smiles: COc1ccc2c(c1)c(Br)cc(n2)C(F)(F)F
Complexity: 274
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 3.8
CatalogNumber:
AD62751
ChemicalName:
4-Bromo-6-methoxy-2-(trifluoromethyl)quinoline
CasNumber:
18706-38-2
MolecularFormula:
C11H7BrF3NO
MolecularWeight:
306.0786
MdlNumber:
MFCD11855898
Smiles:
COc1ccc2c(c1)c(Br)cc(n2)C(F)(F)F
Complexity:
274
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
3.8
CatalogNumber: AD62752
ChemicalName: 4,6-Dichloro-2-(trifluoromethyl)quinoline
CasNumber: 18706-33-7
MolecularFormula: C10H4Cl2F3N
MolecularWeight: 266.0467
MdlNumber: MFCD00276578
Smiles: Clc1ccc2c(c1)c(Cl)cc(n2)C(F)(F)F
Complexity: 259
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 4.4
CatalogNumber:
AD62752
ChemicalName:
4,6-Dichloro-2-(trifluoromethyl)quinoline
CasNumber:
18706-33-7
MolecularFormula:
C10H4Cl2F3N
MolecularWeight:
266.0467
MdlNumber:
MFCD00276578
Smiles:
Clc1ccc2c(c1)c(Cl)cc(n2)C(F)(F)F
Complexity:
259
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
4.4