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AI45237

22115-41-9 | 2-Cyanobenzyl bromide

Manufacturer: A2B Chem

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CatalogNumber

AI45237

ChemicalName

2-Cyanobenzyl bromide

CasNumber

22115-41-9

MolecularFormula

C8H6BrN

MolecularWeight

196.0439

MdlNumber

MFCD00001794

Smiles

C1=CC=C(C(=C1)CBr)C#N

Complexity

147

Covalently-bondedUnitCount

1

HeavyAtomCount

10

HydrogenBondAcceptorCount

1

RotatableBondCount

1

Xlogp3

2.4

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A2B Chem

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CatalogNumber:

AI45237

ChemicalName:

2-Cyanobenzyl bromide

CasNumber:

22115-41-9

MolecularFormula:

C8H6BrN

MolecularWeight:

196.0439

MdlNumber:

MFCD00001794

Smiles:

C1=CC=C(C(=C1)CBr)C#N

Complexity:

147

Covalently-bondedUnitCount:

1

HeavyAtomCount:

10

HydrogenBondAcceptorCount:

1

RotatableBondCount:

1

Xlogp3:

2.4

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

[N-]=[N+]=NCCc1c[nH]c(=O)[nH]c1=O

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

RotatableBondCount:

Xlogp3:

A2B Chem

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CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

OS(=O)(=O)c1ccc(cc1)C1=[C]23C=C/C/3=C(/C3=N/C(=C(c4n([Mn]2Cl)c(/C(=C/2N=C1C=C2)/c1ccc(cc1)S(=O)(=O)O)cc4)/c1ccc(cc1)S(=O)(=O)O)/C=C3)c1ccc(cc1)S(=O)(=O)O

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

RotatableBondCount:

Xlogp3:

A2B Chem

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CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

CCOC(=O)Cc1c[nH]c2c1cc(Cl)cc2

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

RotatableBondCount:

Xlogp3: