AE62243
1415819-87-2 | 5-Ethoxy-2-nitrobenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE62243
ChemicalName
5-Ethoxy-2-nitrobenzonitrile
CasNumber
1415819-87-2
MolecularFormula
C9H8N2O3
MolecularWeight
192.1714
MdlNumber
MFCD22586697
Smiles
CCOc1ccc(c(c1)C#N)[N+](=O)[O-]
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AE62243
ChemicalName: 5-Ethoxy-2-nitrobenzonitrile
CasNumber: 1415819-87-2
MolecularFormula: C9H8N2O3
MolecularWeight: 192.1714
MdlNumber: MFCD22586697
Smiles: CCOc1ccc(c(c1)C#N)[N+](=O)[O-]
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AE62243
ChemicalName:
5-Ethoxy-2-nitrobenzonitrile
CasNumber:
1415819-87-2
MolecularFormula:
C9H8N2O3
MolecularWeight:
192.1714
MdlNumber:
MFCD22586697
Smiles:
CCOc1ccc(c(c1)C#N)[N+](=O)[O-]
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: AE62244
ChemicalName: 5-Ethoxy-2-nitrobenzamide
CasNumber: 1420800-21-0
MolecularFormula: C9H10N2O4
MolecularWeight: 210.1867
MdlNumber: MFCD22689133
Smiles: CCOc1ccc(c(c1)C(=O)N)[N+](=O)[O-]
Complexity: 251
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AE62244
ChemicalName:
5-Ethoxy-2-nitrobenzamide
CasNumber:
1420800-21-0
MolecularFormula:
C9H10N2O4
MolecularWeight:
210.1867
MdlNumber:
MFCD22689133
Smiles:
CCOc1ccc(c(c1)C(=O)N)[N+](=O)[O-]
Complexity:
251
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1cc(ccc1OCC1CC1)B(O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1cc(ccc1OCC1CC1)B(O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE62246
ChemicalName: 2-[4-(Ethoxycarbonyl)-3-fluorophenyl]phenol
CasNumber: 1261975-80-7
MolecularFormula: C15H13FO3
MolecularWeight: 260.2603
MdlNumber: MFCD18313010
Smiles: CCOC(=O)c1ccc(cc1F)c1ccccc1O
Complexity: 308
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 3.5
CatalogNumber:
AE62246
ChemicalName:
2-[4-(Ethoxycarbonyl)-3-fluorophenyl]phenol
CasNumber:
1261975-80-7
MolecularFormula:
C15H13FO3
MolecularWeight:
260.2603
MdlNumber:
MFCD18313010
Smiles:
CCOC(=O)c1ccc(cc1F)c1ccccc1O
Complexity:
308
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
3.5