AB73763
5396-71-4 | Ethyl 3-nitrocinnamate
Manufacturer: A2B Chem
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CatalogNumber
AB73763
ChemicalName
Ethyl 3-nitrocinnamate
CasNumber
5396-71-4
MolecularFormula
C11H11NO4
MolecularWeight
221.20934
MdlNumber
MFCD00017027
Smiles
CCOC(=O)C=Cc1cccc(c1)[N+](=O)[O-]
NscNumber
4346
Complexity
282
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
2.2
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CatalogNumber: AB73763
ChemicalName: Ethyl 3-nitrocinnamate
CasNumber: 5396-71-4
MolecularFormula: C11H11NO4
MolecularWeight: 221.20934
MdlNumber: MFCD00017027
Smiles: CCOC(=O)C=Cc1cccc(c1)[N+](=O)[O-]
NscNumber: 4346
Complexity: 282
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.2
CatalogNumber:
AB73763
ChemicalName:
Ethyl 3-nitrocinnamate
CasNumber:
5396-71-4
MolecularFormula:
C11H11NO4
MolecularWeight:
221.20934
MdlNumber:
MFCD00017027
Smiles:
CCOC(=O)C=Cc1cccc(c1)[N+](=O)[O-]
NscNumber:
4346
Complexity:
282
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.2
CatalogNumber: AB73764
ChemicalName: tert-Butyl 3-(3-ethoxy-3-oxopropanoyl)piperidine-1-carboxylate
CasNumber: 877173-80-3
MolecularFormula: C15H25NO5
MolecularWeight: 299.3627
MdlNumber: MFCD04115571
Smiles: CCOC(=O)CC(=O)C1CCCN(C1)C(=O)OC(C)(C)C
NscNumber: __
Complexity: 399
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 7
Xlogp3: 1.7
CatalogNumber:
AB73764
ChemicalName:
tert-Butyl 3-(3-ethoxy-3-oxopropanoyl)piperidine-1-carboxylate
CasNumber:
877173-80-3
MolecularFormula:
C15H25NO5
MolecularWeight:
299.3627
MdlNumber:
MFCD04115571
Smiles:
CCOC(=O)CC(=O)C1CCCN(C1)C(=O)OC(C)(C)C
NscNumber:
__
Complexity:
399
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
7
Xlogp3:
1.7
CatalogNumber: AB73765
ChemicalName: tert-Butyl 4-(3-ethoxy-3-oxopropanoyl)piperidine-1-carboxylate
CasNumber: 479630-08-5
MolecularFormula: C15H25NO5
MolecularWeight: 299.3627
MdlNumber: MFCD04115569
Smiles: CCOC(=O)CC(=O)C1CCN(CC1)C(=O)OC(C)(C)C
NscNumber: __
Complexity: 391
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 7
Xlogp3: 1.7
CatalogNumber:
AB73765
ChemicalName:
tert-Butyl 4-(3-ethoxy-3-oxopropanoyl)piperidine-1-carboxylate
CasNumber:
479630-08-5
MolecularFormula:
C15H25NO5
MolecularWeight:
299.3627
MdlNumber:
MFCD04115569
Smiles:
CCOC(=O)CC(=O)C1CCN(CC1)C(=O)OC(C)(C)C
NscNumber:
__
Complexity:
391
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
7
Xlogp3:
1.7
CatalogNumber: AB73766
ChemicalName: Ethyl-2-tetrahydrofurfuroyl-acetate
CasNumber: 887411-85-0
MolecularFormula: C9H14O4
MolecularWeight: 186.2051
MdlNumber: MFCD06410652
Smiles: CCOC(=O)CC(=O)C1CCCO1
NscNumber: __
Complexity: 200
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 0.7
CatalogNumber:
AB73766
ChemicalName:
Ethyl-2-tetrahydrofurfuroyl-acetate
CasNumber:
887411-85-0
MolecularFormula:
C9H14O4
MolecularWeight:
186.2051
MdlNumber:
MFCD06410652
Smiles:
CCOC(=O)CC(=O)C1CCCO1
NscNumber:
__
Complexity:
200
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
0.7