AB44273
93071-75-1 | 3-(Trifluoromethoxy)benzylamine
Manufacturer: A2B Chem
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CatalogNumber
AB44273
ChemicalName
3-(Trifluoromethoxy)benzylamine
CasNumber
93071-75-1
MolecularFormula
C8H8F3NO
MolecularWeight
191.1504
MdlNumber
MFCD00061267
Smiles
NCc1cccc(c1)OC(F)(F)F
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AB44273
ChemicalName: 3-(Trifluoromethoxy)benzylamine
CasNumber: 93071-75-1
MolecularFormula: C8H8F3NO
MolecularWeight: 191.1504
MdlNumber: MFCD00061267
Smiles: NCc1cccc(c1)OC(F)(F)F
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AB44273
ChemicalName:
3-(Trifluoromethoxy)benzylamine
CasNumber:
93071-75-1
MolecularFormula:
C8H8F3NO
MolecularWeight:
191.1504
MdlNumber:
MFCD00061267
Smiles:
NCc1cccc(c1)OC(F)(F)F
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AB44274
ChemicalName: 3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine, HCl
CasNumber: 762240-92-6
MolecularFormula: C6H8ClF3N4
MolecularWeight: 228.6027
MdlNumber: MFCD09817638
Smiles: FC(c1nnc2n1CCNC2)(F)F.Cl
Complexity: 195
Covalently-bondedUnitCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB44274
ChemicalName:
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine, HCl
CasNumber:
762240-92-6
MolecularFormula:
C6H8ClF3N4
MolecularWeight:
228.6027
MdlNumber:
MFCD09817638
Smiles:
FC(c1nnc2n1CCNC2)(F)F.Cl
Complexity:
195
Covalently-bondedUnitCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB44275
ChemicalName: 3'-(Trifluoromethyl)acetophenone
CasNumber: 349-76-8
MolecularFormula: C9H7F3O
MolecularWeight: 188.1465
MdlNumber: MFCD00021929
Smiles: CC(=O)c1cccc(c1)C(F)(F)F
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AB44275
ChemicalName:
3'-(Trifluoromethyl)acetophenone
CasNumber:
349-76-8
MolecularFormula:
C9H7F3O
MolecularWeight:
188.1465
MdlNumber:
MFCD00021929
Smiles:
CC(=O)c1cccc(c1)C(F)(F)F
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
3
CatalogNumber: AB44276
ChemicalName: 3-(Trifluoromethyl)benzaldehyde
CasNumber: 454-89-7
MolecularFormula: C8H5F3O
MolecularWeight: 174.1199
MdlNumber: MFCD00003373
Smiles: O=Cc1cccc(c1)C(F)(F)F
Complexity: 164
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AB44276
ChemicalName:
3-(Trifluoromethyl)benzaldehyde
CasNumber:
454-89-7
MolecularFormula:
C8H5F3O
MolecularWeight:
174.1199
MdlNumber:
MFCD00003373
Smiles:
O=Cc1cccc(c1)C(F)(F)F
Complexity:
164
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.5