AX52868
1956356-17-4 | Ethyl 2-(4-bromo-2-chloro-6-cyanophenoxy)acetate
Manufacturer: A2B Chem
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CatalogNumber
AX52868
ChemicalName
Ethyl 2-(4-bromo-2-chloro-6-cyanophenoxy)acetate
CasNumber
1956356-17-4
MolecularFormula
C11H9BrClNO3
MolecularWeight
318.5511
MdlNumber
MFCD29059350
Smiles
CCOC(=O)COc1c(Cl)cc(cc1C#N)Br
Complexity
317
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
3.2
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CatalogNumber: AX52868
ChemicalName: Ethyl 2-(4-bromo-2-chloro-6-cyanophenoxy)acetate
CasNumber: 1956356-17-4
MolecularFormula: C11H9BrClNO3
MolecularWeight: 318.5511
MdlNumber: MFCD29059350
Smiles: CCOC(=O)COc1c(Cl)cc(cc1C#N)Br
Complexity: 317
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 3.2
CatalogNumber:
AX52868
ChemicalName:
Ethyl 2-(4-bromo-2-chloro-6-cyanophenoxy)acetate
CasNumber:
1956356-17-4
MolecularFormula:
C11H9BrClNO3
MolecularWeight:
318.5511
MdlNumber:
MFCD29059350
Smiles:
CCOC(=O)COc1c(Cl)cc(cc1C#N)Br
Complexity:
317
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(NC(=O)CCSSCCC(=O)NC(C)C)C
Complexity: 233
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(NC(=O)CCSSCCC(=O)NC(C)C)C
Complexity:
233
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(=CC(=O)OCC)Nc1cscc1C(=O)OC
Complexity: 451
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(=CC(=O)OCC)Nc1cscc1C(=O)OC
Complexity:
451
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CC1=c2c(C)cccc2=CCN1C(=O)c1ccccc1
Complexity: 633
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CC1=c2c(C)cccc2=CCN1C(=O)c1ccccc1
Complexity:
633
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4