AA89266
166947-09-7 | 3-[4-(Trifluoromethyl)phenyl]propanal
Manufacturer: A2B Chem
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CatalogNumber
AA89266
ChemicalName
3-[4-(Trifluoromethyl)phenyl]propanal
CasNumber
166947-09-7
MolecularFormula
C10H9F3O
MolecularWeight
202.1731
MdlNumber
MFCD07772919
Smiles
O=CCCc1ccc(cc1)C(F)(F)F
Complexity
180
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.5
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CatalogNumber: AA89266
ChemicalName: 3-[4-(Trifluoromethyl)phenyl]propanal
CasNumber: 166947-09-7
MolecularFormula: C10H9F3O
MolecularWeight: 202.1731
MdlNumber: MFCD07772919
Smiles: O=CCCc1ccc(cc1)C(F)(F)F
Complexity: 180
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AA89266
ChemicalName:
3-[4-(Trifluoromethyl)phenyl]propanal
CasNumber:
166947-09-7
MolecularFormula:
C10H9F3O
MolecularWeight:
202.1731
MdlNumber:
MFCD07772919
Smiles:
O=CCCc1ccc(cc1)C(F)(F)F
Complexity:
180
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.5
CatalogNumber: AA89267
ChemicalName: N-Methyl-4-nitrophenethylamine, HCl
CasNumber: 166943-39-1
MolecularFormula: C9H13ClN2O2
MolecularWeight: 216.6647
MdlNumber: MFCD00674535
Smiles: CNCCc1ccc(cc1)[N+](=O)[O-].Cl
Complexity: 160
Covalently-bondedUnitCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AA89267
ChemicalName:
N-Methyl-4-nitrophenethylamine, HCl
CasNumber:
166943-39-1
MolecularFormula:
C9H13ClN2O2
MolecularWeight:
216.6647
MdlNumber:
MFCD00674535
Smiles:
CNCCc1ccc(cc1)[N+](=O)[O-].Cl
Complexity:
160
Covalently-bondedUnitCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)[C@@H]1CC[C@H](N1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)[C@@H]1CC[C@H](N1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(C(=O)N1CCCCC1)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(C(=O)N1CCCCC1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__