AI40326
1820618-34-5 | N-Cyclopropyl-5-ethoxy-2-nitroaniline
Manufacturer: A2B Chem
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CatalogNumber
AI40326
ChemicalName
N-Cyclopropyl-5-ethoxy-2-nitroaniline
CasNumber
1820618-34-5
MolecularFormula
C11H14N2O3
MolecularWeight
222.2405
MdlNumber
MFCD28101657
Smiles
CCOc1ccc(c(c1)NC1CC1)[N+](=O)[O-]
Complexity
250
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3.2
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CatalogNumber: AI40326
ChemicalName: N-Cyclopropyl-5-ethoxy-2-nitroaniline
CasNumber: 1820618-34-5
MolecularFormula: C11H14N2O3
MolecularWeight: 222.2405
MdlNumber: MFCD28101657
Smiles: CCOc1ccc(c(c1)NC1CC1)[N+](=O)[O-]
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.2
CatalogNumber:
AI40326
ChemicalName:
N-Cyclopropyl-5-ethoxy-2-nitroaniline
CasNumber:
1820618-34-5
MolecularFormula:
C11H14N2O3
MolecularWeight:
222.2405
MdlNumber:
MFCD28101657
Smiles:
CCOc1ccc(c(c1)NC1CC1)[N+](=O)[O-]
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(cc(c1)C(=O)OC)c1ccc2c(c1)OCO2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(cc(c1)C(=O)OC)c1ccc2c(c1)OCO2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc2n(c1)nc(n2)Br
Complexity: 157
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc2n(c1)nc(n2)Br
Complexity:
157
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9
CatalogNumber: AI40329
ChemicalName: N-(2-Cyanophenyl)-N-ethylmethanesulfonamide
CasNumber: 1820618-40-3
MolecularFormula: C10H12N2O2S
MolecularWeight: 224.2795
MdlNumber: MFCD28127188
Smiles: CCN(S(=O)(=O)C)c1ccccc1C#N
Complexity: 349
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AI40329
ChemicalName:
N-(2-Cyanophenyl)-N-ethylmethanesulfonamide
CasNumber:
1820618-40-3
MolecularFormula:
C10H12N2O2S
MolecularWeight:
224.2795
MdlNumber:
MFCD28127188
Smiles:
CCN(S(=O)(=O)C)c1ccccc1C#N
Complexity:
349
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
1.2