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AB68098

104-04-1 | 4'-Nitroacetanilide

Manufacturer: A2B Chem

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CatalogNumber

AB68098

ChemicalName

4'-Nitroacetanilide

CasNumber

104-04-1

MolecularFormula

C8H8N2O3

MolecularWeight

180.1607

MdlNumber

MFCD00007303

Smiles

CC(=O)Nc1ccc(cc1)[N+](=O)[O-]

NscNumber

1315

Complexity

204

Covalently-bondedUnitCount

1

HeavyAtomCount

13

HydrogenBondAcceptorCount

3

HydrogenBondDonorCount

1

RotatableBondCount

1

Xlogp3

1.7

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A2B Chem

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CatalogNumber:

AB68098

ChemicalName:

4'-Nitroacetanilide

CasNumber:

104-04-1

MolecularFormula:

C8H8N2O3

MolecularWeight:

180.1607

MdlNumber:

MFCD00007303

Smiles:

CC(=O)Nc1ccc(cc1)[N+](=O)[O-]

NscNumber:

1315

Complexity:

204

Covalently-bondedUnitCount:

1

HeavyAtomCount:

13

HydrogenBondAcceptorCount:

3

HydrogenBondDonorCount:

1

RotatableBondCount:

1

Xlogp3:

1.7

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

O/N=C/c1ccc(cc1)[N+](=O)[O-]

NscNumber:

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

NC(=O)c1ccc(cc1)N(=O)=O

NscNumber:

Complexity:

191

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

0.8

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

O=C(c1ccccc1)Nc1ccc(cc1)[N+](=O)[O-]

NscNumber:

Complexity:

300

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

2.4