AG20798
51656-91-8 | Ethyl 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)acetate
Manufacturer: A2B Chem
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CatalogNumber
AG20798
ChemicalName
Ethyl 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)acetate
CasNumber
51656-91-8
MolecularFormula
C12H18O4
MolecularWeight
226.2689
MdlNumber
MFCD07779434
Smiles
CCOC(=O)C=C1CCC2(CC1)OCCO2
NscNumber
649463
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
1
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CatalogNumber: AG20798
ChemicalName: Ethyl 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)acetate
CasNumber: 51656-91-8
MolecularFormula: C12H18O4
MolecularWeight: 226.2689
MdlNumber: MFCD07779434
Smiles: CCOC(=O)C=C1CCC2(CC1)OCCO2
NscNumber: 649463
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AG20798
ChemicalName:
Ethyl 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)acetate
CasNumber:
51656-91-8
MolecularFormula:
C12H18O4
MolecularWeight:
226.2689
MdlNumber:
MFCD07779434
Smiles:
CCOC(=O)C=C1CCC2(CC1)OCCO2
NscNumber:
649463
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1
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Smiles: CCOC(=O)C(=O)Nc1ccc(cc1)Cl
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Complexity: __
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Smiles:
CCOC(=O)C(=O)Nc1ccc(cc1)Cl
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Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CCOC(=O)c1ccc(cc1)c1ccnc(n1)Cl
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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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:
CCOC(=O)c1ccc(cc1)c1ccnc(n1)Cl
NscNumber:
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Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CCOC(=O)c1nn(c2c1CCN(C2=O)c1ccc(cc1)N)c1ccc(cc1)OC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1nn(c2c1CCN(C2=O)c1ccc(cc1)N)c1ccc(cc1)OC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__