AA77866
1558-81-2 | Ethyl 1-cyanocyclopropanecarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA77866
ChemicalName
Ethyl 1-cyanocyclopropanecarboxylate
CasNumber
1558-81-2
MolecularFormula
C7H9NO2
MolecularWeight
139.1519
MdlNumber
MFCD00040159
Smiles
CCOC(=O)C1(CC1)C#N
NscNumber
666530
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
0.7
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CatalogNumber: AA77866
ChemicalName: Ethyl 1-cyanocyclopropanecarboxylate
CasNumber: 1558-81-2
MolecularFormula: C7H9NO2
MolecularWeight: 139.1519
MdlNumber: MFCD00040159
Smiles: CCOC(=O)C1(CC1)C#N
NscNumber: 666530
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 0.7
CatalogNumber:
AA77866
ChemicalName:
Ethyl 1-cyanocyclopropanecarboxylate
CasNumber:
1558-81-2
MolecularFormula:
C7H9NO2
MolecularWeight:
139.1519
MdlNumber:
MFCD00040159
Smiles:
CCOC(=O)C1(CC1)C#N
NscNumber:
666530
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
0.7
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Smiles: O=COC=O
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HydrogenBondAcceptorCount: __
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Smiles:
O=COC=O
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__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: COc1cc(/C=C/c2cscc2)cc(c1OC)OC
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
COc1cc(/C=C/c2cscc2)cc(c1OC)OC
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: COc1ccc(cc1)/C=C/c1cscc1
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Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)/C=C/c1cscc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__