AA14688
116047-26-8 | Methyl 8-oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylate
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AA14688
ChemicalName
Methyl 8-oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylate
CasNumber
116047-26-8
MolecularFormula
C12H12O3
MolecularWeight
204.2219
MdlNumber
MFCD16037868
Smiles
COC(=O)c1ccc2c(c1)C(=O)CCC2
Complexity
272
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.9
Compare Similar Items
Show Difference
CatalogNumber: AA14688
ChemicalName: Methyl 8-oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylate
CasNumber: 116047-26-8
MolecularFormula: C12H12O3
MolecularWeight: 204.2219
MdlNumber: MFCD16037868
Smiles: COC(=O)c1ccc2c(c1)C(=O)CCC2
Complexity: 272
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AA14688
ChemicalName:
Methyl 8-oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylate
CasNumber:
116047-26-8
MolecularFormula:
C12H12O3
MolecularWeight:
204.2219
MdlNumber:
MFCD16037868
Smiles:
COC(=O)c1ccc2c(c1)C(=O)CCC2
Complexity:
272
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(C)(C)C)N1CCCN(C1)C(=O)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C(C)(C)C)N1CCCN(C1)C(=O)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA14692
ChemicalName: Methyl 3-bromo-4-chloro-5-fluorobenzoate
CasNumber: 1160574-62-8
MolecularFormula: C8H5BrClFO2
MolecularWeight: 267.4795
MdlNumber: MFCD11846086
Smiles: COC(=O)c1cc(F)c(c(c1)Br)Cl
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AA14692
ChemicalName:
Methyl 3-bromo-4-chloro-5-fluorobenzoate
CasNumber:
1160574-62-8
MolecularFormula:
C8H5BrClFO2
MolecularWeight:
267.4795
MdlNumber:
MFCD11846086
Smiles:
COC(=O)c1cc(F)c(c(c1)Br)Cl
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCc1cc(I)ccc1Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCc1cc(I)ccc1Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__