AF28214
2510-99-8 | Ethyl 2-phenylpropionate
Manufacturer: A2B Chem
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CatalogNumber
AF28214
ChemicalName
Ethyl 2-phenylpropionate
CasNumber
2510-99-8
MolecularFormula
C11H14O2
MolecularWeight
178.2277
MdlNumber
MFCD00795471
Smiles
CCOC(=O)C(c1ccccc1)C
NscNumber
254979
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
2.7
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CatalogNumber: AF28214
ChemicalName: Ethyl 2-phenylpropionate
CasNumber: 2510-99-8
MolecularFormula: C11H14O2
MolecularWeight: 178.2277
MdlNumber: MFCD00795471
Smiles: CCOC(=O)C(c1ccccc1)C
NscNumber: 254979
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.7
CatalogNumber:
AF28214
ChemicalName:
Ethyl 2-phenylpropionate
CasNumber:
2510-99-8
MolecularFormula:
C11H14O2
MolecularWeight:
178.2277
MdlNumber:
MFCD00795471
Smiles:
CCOC(=O)C(c1ccccc1)C
NscNumber:
254979
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.7
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Smiles: c1ccc(cc1)OCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
c1ccc(cc1)OCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
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__
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Smiles: CCCCCCCCC(CCCCCCCC)(C(=O)OCC)C(=O)OCC
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Smiles:
CCCCCCCCC(CCCCCCCC)(C(=O)OCC)C(=O)OCC
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Smiles: CCCCCCCCCCCCCCCCCC(=O)O[C@@H]([C@H]1OC[C@@H]([C@H]1OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)CO
NscNumber: __
Complexity: __
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UndefinedAtomStereocenterCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCCCCCCCCCCCCCCCCC(=O)O[C@@H]([C@H]1OC[C@@H]([C@H]1OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)CO
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__