AD35432
40497-11-8 | Ethyl 2,3-dicyanopropionate
Manufacturer: A2B Chem
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CatalogNumber
AD35432
ChemicalName
Ethyl 2,3-dicyanopropionate
CasNumber
40497-11-8
MolecularFormula
C7H8N2O2
MolecularWeight
152.1506
MdlNumber
MFCD08061844
Smiles
CCOC(=O)C(C#N)CC#N
Complexity
229
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
0.1
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CatalogNumber: AD35432
ChemicalName: Ethyl 2,3-dicyanopropionate
CasNumber: 40497-11-8
MolecularFormula: C7H8N2O2
MolecularWeight: 152.1506
MdlNumber: MFCD08061844
Smiles: CCOC(=O)C(C#N)CC#N
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.1
CatalogNumber:
AD35432
ChemicalName:
Ethyl 2,3-dicyanopropionate
CasNumber:
40497-11-8
MolecularFormula:
C7H8N2O2
MolecularWeight:
152.1506
MdlNumber:
MFCD08061844
Smiles:
CCOC(=O)C(C#N)CC#N
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: OC(=O)C(c1c(C)cc(cc1C)C)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)C(c1c(C)cc(cc1C)C)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cccc2c1CCCN2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)c1cccc2c1CCCN2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: N#Cc1c2ccccc2c(c2c1cccc2)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
N#Cc1c2ccccc2c(c2c1cccc2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__