AA37262
126541-81-9 | Methyl 3-nitro-4-trifluoromethylbenzoate
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AA37262
ChemicalName
Methyl 3-nitro-4-trifluoromethylbenzoate
CasNumber
126541-81-9
MolecularFormula
C9H6F3NO4
MolecularWeight
249.1434
MdlNumber
MFCD09264510
Smiles
COC(=O)c1ccc(c(c1)[N+](=O)[O-])C(F)(F)F
Complexity
312
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
7
RotatableBondCount
2
Xlogp3
2.5
Compare Similar Items
Show Difference
CatalogNumber: AA37262
ChemicalName: Methyl 3-nitro-4-trifluoromethylbenzoate
CasNumber: 126541-81-9
MolecularFormula: C9H6F3NO4
MolecularWeight: 249.1434
MdlNumber: MFCD09264510
Smiles: COC(=O)c1ccc(c(c1)[N+](=O)[O-])C(F)(F)F
Complexity: 312
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 7
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AA37262
ChemicalName:
Methyl 3-nitro-4-trifluoromethylbenzoate
CasNumber:
126541-81-9
MolecularFormula:
C9H6F3NO4
MolecularWeight:
249.1434
MdlNumber:
MFCD09264510
Smiles:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])C(F)(F)F
Complexity:
312
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
7
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(c1nc[nH]c(=O)c1)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(c1nc[nH]c(=O)c1)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=c1[nH]cnc(c1Br)C(F)(F)F
Complexity: 281
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=c1[nH]cnc(c1Br)C(F)(F)F
Complexity:
281
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1nnn(c1N)Cc1ccccc1)Nc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1nnn(c1N)Cc1ccccc1)Nc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__