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AJ17093

58016-28-7 | Methyl 2,4-dihydroxy-6-pentylbenzoate

Manufacturer: A2B Chem

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CatalogNumber

AJ17093

ChemicalName

Methyl 2,4-dihydroxy-6-pentylbenzoate

CasNumber

58016-28-7

MolecularFormula

C13H18O4

MolecularWeight

238.2796

MdlNumber

MFCD06737776

Smiles

CCCCCc1cc(O)cc(c1C(=O)OC)O

Complexity

242

Covalently-bondedUnitCount

1

HeavyAtomCount

17

HydrogenBondAcceptorCount

4

HydrogenBondDonorCount

2

RotatableBondCount

6

Xlogp3

4

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A2B Chem

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CatalogNumber:

AJ17093

ChemicalName:

Methyl 2,4-dihydroxy-6-pentylbenzoate

CasNumber:

58016-28-7

MolecularFormula:

C13H18O4

MolecularWeight:

238.2796

MdlNumber:

MFCD06737776

Smiles:

CCCCCc1cc(O)cc(c1C(=O)OC)O

Complexity:

242

Covalently-bondedUnitCount:

1

HeavyAtomCount:

17

HydrogenBondAcceptorCount:

4

HydrogenBondDonorCount:

2

RotatableBondCount:

6

Xlogp3:

4

A2B Chem

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CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

CCCCCc1cc2OC(C)(C)[C@H]3[C@H](c2c(c1C(=O)O)O)CC(=CC3)C

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

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A2B Chem

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CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

[2H]C(c1cc(OCC2CNC(=O)O2)cc(c1)C([2H])([2H])[2H])([2H])[2H]

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

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A2B Chem

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CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

OCC(=O)[C@H]1[C@H](C)C[C@@H]2[C@]1(C)C[C@H](O)[C@]1([C@H]2CCC2=CC(=O)C=C[C@]12C)F

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

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