AA59780
1391077-73-8 | 1-tert-Butyl 2-ethyl 2-methylazetidine-1,2-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA59780
ChemicalName
1-tert-Butyl 2-ethyl 2-methylazetidine-1,2-dicarboxylate
CasNumber
1391077-73-8
MolecularFormula
C12H21NO4
MolecularWeight
243.2994
MdlNumber
MFCD24387386
Smiles
CCOC(=O)C1(C)CCN1C(=O)OC(C)(C)C
Complexity
321
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
Xlogp3
1.8
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CatalogNumber: AA59780
ChemicalName: 1-tert-Butyl 2-ethyl 2-methylazetidine-1,2-dicarboxylate
CasNumber: 1391077-73-8
MolecularFormula: C12H21NO4
MolecularWeight: 243.2994
MdlNumber: MFCD24387386
Smiles: CCOC(=O)C1(C)CCN1C(=O)OC(C)(C)C
Complexity: 321
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.8
CatalogNumber:
AA59780
ChemicalName:
1-tert-Butyl 2-ethyl 2-methylazetidine-1,2-dicarboxylate
CasNumber:
1391077-73-8
MolecularFormula:
C12H21NO4
MolecularWeight:
243.2994
MdlNumber:
MFCD24387386
Smiles:
CCOC(=O)C1(C)CCN1C(=O)OC(C)(C)C
Complexity:
321
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.8
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Smiles: N#Cc1[nH]ccc1I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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MolecularFormula:
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MdlNumber:
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Smiles:
N#Cc1[nH]ccc1I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCc2c1ccc(c2N)I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCc2c1ccc(c2N)I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: Cc1cc(I)c2c(c1)C(=O)CC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cc(I)c2c(c1)C(=O)CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__