AB59026
951918-29-9 | 2-(4-Bromo-3,5-dimethylphenoxy)acetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB59026
ChemicalName
2-(4-Bromo-3,5-dimethylphenoxy)acetonitrile
CasNumber
951918-29-9
MolecularFormula
C10H10BrNO
MolecularWeight
240.0965
MdlNumber
MFCD09906444
Smiles
N#CCOc1cc(C)c(c(c1)C)Br
Complexity
198
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AB59026
ChemicalName: 2-(4-Bromo-3,5-dimethylphenoxy)acetonitrile
CasNumber: 951918-29-9
MolecularFormula: C10H10BrNO
MolecularWeight: 240.0965
MdlNumber: MFCD09906444
Smiles: N#CCOc1cc(C)c(c(c1)C)Br
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AB59026
ChemicalName:
2-(4-Bromo-3,5-dimethylphenoxy)acetonitrile
CasNumber:
951918-29-9
MolecularFormula:
C10H10BrNO
MolecularWeight:
240.0965
MdlNumber:
MFCD09906444
Smiles:
N#CCOc1cc(C)c(c(c1)C)Br
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.1
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Smiles: N#CCc1c[nH]c2c1c(Br)ccc2
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Smiles:
N#CCc1c[nH]c2c1c(Br)ccc2
Complexity:
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Smiles: Clc1cccc(n1)n1nc(c(c1C(F)(F)F)Br)C
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Clc1cccc(n1)n1nc(c(c1C(F)(F)F)Br)C
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Smiles: Brc1ccc(cc1)C(=O)NCCOC(=O)c1ccc(cc1)Br
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Smiles:
Brc1ccc(cc1)C(=O)NCCOC(=O)c1ccc(cc1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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