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AB52306

7251-09-4 | 4-Amino-2-methoxybenzonitrile

Manufacturer: A2B Chem

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CatalogNumber

AB52306

ChemicalName

4-Amino-2-methoxybenzonitrile

CasNumber

7251-09-4

MolecularFormula

C8H8N2O

MolecularWeight

148.16191999999998

MdlNumber

MFCD09027303

Smiles

COc1cc(N)ccc1C#N

NscNumber

30614

Complexity

172

Covalently-bondedUnitCount

1

HeavyAtomCount

11

HydrogenBondAcceptorCount

3

HydrogenBondDonorCount

1

RotatableBondCount

1

Xlogp3

1.7

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A2B Chem

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CatalogNumber:

AB52306

ChemicalName:

4-Amino-2-methoxybenzonitrile

CasNumber:

7251-09-4

MolecularFormula:

C8H8N2O

MolecularWeight:

148.16191999999998

MdlNumber:

MFCD09027303

Smiles:

COc1cc(N)ccc1C#N

NscNumber:

30614

Complexity:

172

Covalently-bondedUnitCount:

1

HeavyAtomCount:

11

HydrogenBondAcceptorCount:

3

HydrogenBondDonorCount:

1

RotatableBondCount:

1

Xlogp3:

1.7

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)F)n1ccc(=O)[nH]c1=O

NscNumber:

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

NC=O

NscNumber:

Complexity:

12.3

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

-0.8

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

CCOc1cc(ccc1OC)[C@H](N1C(=O)c2c(C1=O)c(ccc2)NC(=O)C)CS(=O)(=O)C

NscNumber:

Complexity:

825

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

1.8