AA94360
1754-55-8 | Ethyl 2,4,6-trimethylbenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA94360
ChemicalName
Ethyl 2,4,6-trimethylbenzoate
CasNumber
1754-55-8
MolecularFormula
C12H16O2
MolecularWeight
192.25423999999998
MdlNumber
MFCD00015439
Smiles
CCOC(=O)c1c(C)cc(cc1C)C
NscNumber
229348
Complexity
189
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
3.2
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CatalogNumber: AA94360
ChemicalName: Ethyl 2,4,6-trimethylbenzoate
CasNumber: 1754-55-8
MolecularFormula: C12H16O2
MolecularWeight: 192.25423999999998
MdlNumber: MFCD00015439
Smiles: CCOC(=O)c1c(C)cc(cc1C)C
NscNumber: 229348
Complexity: 189
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AA94360
ChemicalName:
Ethyl 2,4,6-trimethylbenzoate
CasNumber:
1754-55-8
MolecularFormula:
C12H16O2
MolecularWeight:
192.25423999999998
MdlNumber:
MFCD00015439
Smiles:
CCOC(=O)c1c(C)cc(cc1C)C
NscNumber:
229348
Complexity:
189
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1c2ccccc2cc2c1cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1c2ccccc2cc2c1cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOP(=O)(c1ccccc1)OCC
NscNumber: __
Complexity: 190
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOP(=O)(c1ccccc1)OCC
NscNumber:
__
Complexity:
190
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCOP(=O)(c1ccccc1)OCCCCCCCC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCCOP(=O)(c1ccccc1)OCCCCCCCC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__