AV18762
42392-68-7 | Diethyl 2-cyclopropylmalonate
Manufacturer: A2B Chem
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CatalogNumber
AV18762
ChemicalName
Diethyl 2-cyclopropylmalonate
CasNumber
42392-68-7
MolecularFormula
C10H16O4
MolecularWeight
200.2316
MdlNumber
MFCD25963390
Smiles
CCOC(=O)C(C(=O)OCC)C1CC1
Complexity
202
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
7
Xlogp3
2
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CatalogNumber: AV18762
ChemicalName: Diethyl 2-cyclopropylmalonate
CasNumber: 42392-68-7
MolecularFormula: C10H16O4
MolecularWeight: 200.2316
MdlNumber: MFCD25963390
Smiles: CCOC(=O)C(C(=O)OCC)C1CC1
Complexity: 202
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 7
Xlogp3: 2
CatalogNumber:
AV18762
ChemicalName:
Diethyl 2-cyclopropylmalonate
CasNumber:
42392-68-7
MolecularFormula:
C10H16O4
MolecularWeight:
200.2316
MdlNumber:
MFCD25963390
Smiles:
CCOC(=O)C(C(=O)OCC)C1CC1
Complexity:
202
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
7
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CC[C@@H]1[C@H](O)CCCN1C(=O)OC(C)(C)C
Complexity: 283
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=CC[C@@H]1[C@H](O)CCCN1C(=O)OC(C)(C)C
Complexity:
283
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)[C@H](O)[C@@H](C1C2CC[C@]2(C1CCC2[C@@H](CCC(=O)NCC(=O)O)C)C)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@@H]1CC[C@]2([C@@H](C1)[C@H](O)[C@@H](C1C2CC[C@]2(C1CCC2[C@@H](CCC(=O)NCC(=O)O)C)C)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1ccc(c(c1)Br)Cl
Complexity: 176
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)Nc1ccc(c(c1)Br)Cl
Complexity:
176
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.3