AB46116
1570-45-2 | Ethyl isonicotinate
Manufacturer: A2B Chem
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CatalogNumber
AB46116
ChemicalName
Ethyl isonicotinate
CasNumber
1570-45-2
MolecularFormula
C8H9NO2
MolecularWeight
151.1626
MdlNumber
MFCD00006428
Smiles
CCOC(=O)c1ccncc1
NscNumber
6854
Complexity
130
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.4
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CatalogNumber: AB46116
ChemicalName: Ethyl isonicotinate
CasNumber: 1570-45-2
MolecularFormula: C8H9NO2
MolecularWeight: 151.1626
MdlNumber: MFCD00006428
Smiles: CCOC(=O)c1ccncc1
NscNumber: 6854
Complexity: 130
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AB46116
ChemicalName:
Ethyl isonicotinate
CasNumber:
1570-45-2
MolecularFormula:
C8H9NO2
MolecularWeight:
151.1626
MdlNumber:
MFCD00006428
Smiles:
CCOC(=O)c1ccncc1
NscNumber:
6854
Complexity:
130
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CC(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)CC(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(O)C
NscNumber: __
Complexity: 79.7
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(O)C
NscNumber:
__
Complexity:
79.7
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.2
CatalogNumber: AB46119
ChemicalName: Ethyl levulinate
CasNumber: 539-88-8
MolecularFormula: C7H12O3
MolecularWeight: 144.1684
MdlNumber: MFCD00009209
Smiles: CCOC(=O)CCC(=O)C
NscNumber: __
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 0.1
CatalogNumber:
AB46119
ChemicalName:
Ethyl levulinate
CasNumber:
539-88-8
MolecularFormula:
C7H12O3
MolecularWeight:
144.1684
MdlNumber:
MFCD00009209
Smiles:
CCOC(=O)CCC(=O)C
NscNumber:
__
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
0.1