AB06385
20561-09-5 | Diethyl 1,2-cyclopropanedicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB06385
ChemicalName
Diethyl 1,2-cyclopropanedicarboxylate
CasNumber
20561-09-5
MolecularFormula
C9H14O4
MolecularWeight
186.2051
MdlNumber
MFCD00001286
Smiles
CCOC(=O)C1CC1C(=O)OCC
NscNumber
122105
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
6
UndefinedAtomStereocenterCount
2
Xlogp3
0.8
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CatalogNumber: AB06385
ChemicalName: Diethyl 1,2-cyclopropanedicarboxylate
CasNumber: 20561-09-5
MolecularFormula: C9H14O4
MolecularWeight: 186.2051
MdlNumber: MFCD00001286
Smiles: CCOC(=O)C1CC1C(=O)OCC
NscNumber: 122105
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 6
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.8
CatalogNumber:
AB06385
ChemicalName:
Diethyl 1,2-cyclopropanedicarboxylate
CasNumber:
20561-09-5
MolecularFormula:
C9H14O4
MolecularWeight:
186.2051
MdlNumber:
MFCD00001286
Smiles:
CCOC(=O)C1CC1C(=O)OCC
NscNumber:
122105
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
6
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.8
CatalogNumber: AB06386
ChemicalName: Oxibendazole
CasNumber: 20559-55-1
MolecularFormula: C12H15N3O3
MolecularWeight: 249.2658
MdlNumber: MFCD00133728
Smiles: CCCOc1ccc2c(c1)[nH]c(n2)NC(=O)OC
NscNumber: 758459
Complexity: 288
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
UndefinedAtomStereocenterCount: __
Xlogp3: 2.4
CatalogNumber:
AB06386
ChemicalName:
Oxibendazole
CasNumber:
20559-55-1
MolecularFormula:
C12H15N3O3
MolecularWeight:
249.2658
MdlNumber:
MFCD00133728
Smiles:
CCCOc1ccc2c(c1)[nH]c(n2)NC(=O)OC
NscNumber:
758459
Complexity:
288
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@H]1C[C@@H](O[C@@H]1COP(=O)(OP(=O)(OP(=O)(O)O)O)O)n1ccc(nc1=O)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@H]1C[C@@H](O[C@@H]1COP(=O)(OP(=O)(OP(=O)(O)O)O)O)n1ccc(nc1=O)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC1C(=O)N2N(C1=O)c1ccccc1C(=C2)c1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCC1C(=O)N2N(C1=O)c1ccccc1C(=C2)c1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__