AA51869
1330750-39-4 | 4-Bromo-5-ethoxy-N-isopropyl-2-nitroaniline
Manufacturer: A2B Chem
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CatalogNumber
AA51869
ChemicalName
4-Bromo-5-ethoxy-N-isopropyl-2-nitroaniline
CasNumber
1330750-39-4
MolecularFormula
C11H15BrN2O3
MolecularWeight
303.1524
MdlNumber
MFCD19981503
Smiles
CCOc1cc(NC(C)C)c(cc1Br)[N+](=O)[O-]
Complexity
258
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
4.1
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CatalogNumber: AA51869
ChemicalName: 4-Bromo-5-ethoxy-N-isopropyl-2-nitroaniline
CasNumber: 1330750-39-4
MolecularFormula: C11H15BrN2O3
MolecularWeight: 303.1524
MdlNumber: MFCD19981503
Smiles: CCOc1cc(NC(C)C)c(cc1Br)[N+](=O)[O-]
Complexity: 258
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 4.1
CatalogNumber:
AA51869
ChemicalName:
4-Bromo-5-ethoxy-N-isopropyl-2-nitroaniline
CasNumber:
1330750-39-4
MolecularFormula:
C11H15BrN2O3
MolecularWeight:
303.1524
MdlNumber:
MFCD19981503
Smiles:
CCOc1cc(NC(C)C)c(cc1Br)[N+](=O)[O-]
Complexity:
258
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(cc1F)OCC(C)C
Complexity: 230
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(cc1F)OCC(C)C
Complexity:
230
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cccc(n1)c1cc(F)ccc1C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cccc(n1)c1cc(F)ccc1C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA51872
ChemicalName: (+/-)-Trans-4-isopropyl-pyrrolidine-3-carboxylic acid, HCl
CasNumber: 1330750-36-1
MolecularFormula: C8H16ClNO2
MolecularWeight: 193.6711
MdlNumber: MFCD06659329
Smiles: CC([C@H]1CNC[C@@H]1C(=O)O)C.Cl
Complexity: 156
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AA51872
ChemicalName:
(+/-)-Trans-4-isopropyl-pyrrolidine-3-carboxylic acid, HCl
CasNumber:
1330750-36-1
MolecularFormula:
C8H16ClNO2
MolecularWeight:
193.6711
MdlNumber:
MFCD06659329
Smiles:
CC([C@H]1CNC[C@@H]1C(=O)O)C.Cl
Complexity:
156
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
__