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AB67949

40870-59-5 | 4-Methyl-3-nitrobenzyl alcohol

Manufacturer: A2B Chem

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CatalogNumber

AB67949

ChemicalName

4-Methyl-3-nitrobenzyl alcohol

CasNumber

40870-59-5

MolecularFormula

C8H9NO3

MolecularWeight

167.162

MdlNumber

MFCD00007177

Smiles

OCc1ccc(c(c1)[N+](=O)[O-])C

Complexity

166

Covalently-bondedUnitCount

1

HeavyAtomCount

12

HydrogenBondAcceptorCount

3

HydrogenBondDonorCount

1

RotatableBondCount

1

Xlogp3

1.2

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A2B Chem

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CatalogNumber:

AB67949

ChemicalName:

4-Methyl-3-nitrobenzyl alcohol

CasNumber:

40870-59-5

MolecularFormula:

C8H9NO3

MolecularWeight:

167.162

MdlNumber:

MFCD00007177

Smiles:

OCc1ccc(c(c1)[N+](=O)[O-])C

Complexity:

166

Covalently-bondedUnitCount:

1

HeavyAtomCount:

12

HydrogenBondAcceptorCount:

3

HydrogenBondDonorCount:

1

RotatableBondCount:

1

Xlogp3:

1.2

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

O=C=Nc1ccc(c(c1)N(=O)=O)C

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

__

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

OCCC=C(C)C

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

__

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

CNC(=S)NN

Complexity:

52.8

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

__

Xlogp3:

-0.8