AC55249
7153-22-2 | Ethyl 4-cyanobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AC55249
ChemicalName
Ethyl 4-cyanobenzoate
CasNumber
7153-22-2
MolecularFormula
C10H9NO2
MolecularWeight
175.184
MdlNumber
MFCD00001824
Smiles
CCOC(=O)c1ccc(cc1)C#N
NscNumber
62689
Complexity
220
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.5
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CatalogNumber: AC55249
ChemicalName: Ethyl 4-cyanobenzoate
CasNumber: 7153-22-2
MolecularFormula: C10H9NO2
MolecularWeight: 175.184
MdlNumber: MFCD00001824
Smiles: CCOC(=O)c1ccc(cc1)C#N
NscNumber: 62689
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AC55249
ChemicalName:
Ethyl 4-cyanobenzoate
CasNumber:
7153-22-2
MolecularFormula:
C10H9NO2
MolecularWeight:
175.184
MdlNumber:
MFCD00001824
Smiles:
CCOC(=O)c1ccc(cc1)C#N
NscNumber:
62689
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
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MolecularWeight: __
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Smiles: CC(c1cccc(c1)S(=O)(=O)Cl)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(c1cccc(c1)S(=O)(=O)Cl)C
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CSC(c1ccccc1)Nc1ccccc1C(=O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CSC(c1ccccc1)Nc1ccccc1C(=O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(C(=O)c1ccc(cc1)OC)C(=O)c1ccc(cc1)OC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(C(=O)c1ccc(cc1)OC)C(=O)c1ccc(cc1)OC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__