AA36173
1261862-72-9 | Ethyl 2-(3-bromo-2-methylphenyl)acetate
Manufacturer: A2B Chem
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CatalogNumber
AA36173
ChemicalName
Ethyl 2-(3-bromo-2-methylphenyl)acetate
CasNumber
1261862-72-9
MolecularFormula
C11H13BrO2
MolecularWeight
257.1237
MdlNumber
MFCD18395994
Smiles
Cc1c(CC(=O)OCC)cccc1Br
Complexity
194
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
4
Xlogp3
3.1
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CatalogNumber: AA36173
ChemicalName: Ethyl 2-(3-bromo-2-methylphenyl)acetate
CasNumber: 1261862-72-9
MolecularFormula: C11H13BrO2
MolecularWeight: 257.1237
MdlNumber: MFCD18395994
Smiles: Cc1c(CC(=O)OCC)cccc1Br
Complexity: 194
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 3.1
CatalogNumber:
AA36173
ChemicalName:
Ethyl 2-(3-bromo-2-methylphenyl)acetate
CasNumber:
1261862-72-9
MolecularFormula:
C11H13BrO2
MolecularWeight:
257.1237
MdlNumber:
MFCD18395994
Smiles:
Cc1c(CC(=O)OCC)cccc1Br
Complexity:
194
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
3.1
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Smiles: N#CCc1c(cccc1F)OC(F)F
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
N#CCc1c(cccc1F)OC(F)F
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COc1cc(C#N)cc(c1)S(=O)(=O)Cl
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Smiles:
COc1cc(C#N)cc(c1)S(=O)(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: OCc1cccc(c1F)C#N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
OCc1cccc(c1F)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__