AA50510
1373232-62-2 | 2-Nitro-5-(trifluoromethoxy)benzamide
Manufacturer: A2B Chem
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CatalogNumber
AA50510
ChemicalName
2-Nitro-5-(trifluoromethoxy)benzamide
CasNumber
1373232-62-2
MolecularFormula
C8H5F3N2O4
MolecularWeight
250.1315
MdlNumber
MFCD22192357
Smiles
NC(=O)c1cc(ccc1[N+](=O)[O-])OC(F)(F)F
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2
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CatalogNumber: AA50510
ChemicalName: 2-Nitro-5-(trifluoromethoxy)benzamide
CasNumber: 1373232-62-2
MolecularFormula: C8H5F3N2O4
MolecularWeight: 250.1315
MdlNumber: MFCD22192357
Smiles: NC(=O)c1cc(ccc1[N+](=O)[O-])OC(F)(F)F
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AA50510
ChemicalName:
2-Nitro-5-(trifluoromethoxy)benzamide
CasNumber:
1373232-62-2
MolecularFormula:
C8H5F3N2O4
MolecularWeight:
250.1315
MdlNumber:
MFCD22192357
Smiles:
NC(=O)c1cc(ccc1[N+](=O)[O-])OC(F)(F)F
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: AA50511
ChemicalName: 5-Amino-3-(trifluoromethyl)pyridin-2-ol
CasNumber: 1373232-58-6
MolecularFormula: C6H5F3N2O
MolecularWeight: 178.11190959999996
MdlNumber: MFCD23726507
Smiles: FC(c1cc(N)c[nH]c1=O)(F)F
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: 0.1
CatalogNumber:
AA50511
ChemicalName:
5-Amino-3-(trifluoromethyl)pyridin-2-ol
CasNumber:
1373232-58-6
MolecularFormula:
C6H5F3N2O
MolecularWeight:
178.11190959999996
MdlNumber:
MFCD23726507
Smiles:
FC(c1cc(N)c[nH]c1=O)(F)F
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(cc(c1)c1ccc(c(c1)C(=O)O)F)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(cc(c1)c1ccc(c(c1)C(=O)O)F)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA50513
ChemicalName: 4-Bromo-5-methyl-2-(oxan-2-yl)pyrazole-3-carbaldehyde
CasNumber: 1373232-52-0
MolecularFormula: C10H13BrN2O2
MolecularWeight: 273.1264
MdlNumber: MFCD22192548
Smiles: O=Cc1c(Br)c(nn1C1CCCCO1)C
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AA50513
ChemicalName:
4-Bromo-5-methyl-2-(oxan-2-yl)pyrazole-3-carbaldehyde
CasNumber:
1373232-52-0
MolecularFormula:
C10H13BrN2O2
MolecularWeight:
273.1264
MdlNumber:
MFCD22192548
Smiles:
O=Cc1c(Br)c(nn1C1CCCCO1)C
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
1.9