AB58513

60728-41-8 | 1-Methyl 2-aminoterephthalate

Manufacturer: A2B Chem

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CatalogNumber

AB58513

ChemicalName

1-Methyl 2-aminoterephthalate

CasNumber

60728-41-8

MolecularFormula

C9H9NO4

MolecularWeight

195.1721

MdlNumber

MFCD00189374

Smiles

COC(=O)c1ccc(cc1N)C(=O)O

Complexity

241

Covalently-bondedUnitCount

1

HeavyAtomCount

14

HydrogenBondAcceptorCount

5

HydrogenBondDonorCount

2

RotatableBondCount

3

Xlogp3

2.2

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A2B Chem

AB58513

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CatalogNumber:
AB58513

ChemicalName:
1-Methyl 2-aminoterephthalate

CasNumber:
60728-41-8

MolecularFormula:
C9H9NO4

MolecularWeight:
195.1721

MdlNumber:
MFCD00189374

Smiles:
COC(=O)c1ccc(cc1N)C(=O)O

Complexity:
241

Covalently-bondedUnitCount:
1

HeavyAtomCount:
14

HydrogenBondAcceptorCount:
5

HydrogenBondDonorCount:
2

RotatableBondCount:
3

Xlogp3:
2.2

Img

A2B Chem

AB58514

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
COC(=O)c1ccc(cc1I)C(=O)O

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AB58515

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
COC(=O)c1ccc(cc1[N+](=O)[O-])C(=O)O

Complexity:
310

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
1.3

Img

A2B Chem

AB58516

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CCCCC(S(=O)(=O)O)C(=O)OC

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__