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AI53868

62285-58-9 | 2,6-Dimethylbenzyl alcohol

Manufacturer: A2B Chem

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CatalogNumber

AI53868

ChemicalName

2,6-Dimethylbenzyl alcohol

CasNumber

62285-58-9

MolecularFormula

C9H12O

MolecularWeight

136.191

MdlNumber

MFCD00128004

Smiles

OCc1c(C)cccc1C

NscNumber

618295

Complexity

90.9

Covalently-bondedUnitCount

1

HeavyAtomCount

10

HydrogenBondAcceptorCount

1

HydrogenBondDonorCount

1

RotatableBondCount

1

Xlogp3

1.8

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A2B Chem

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CatalogNumber:

AI53868

ChemicalName:

2,6-Dimethylbenzyl alcohol

CasNumber:

62285-58-9

MolecularFormula:

C9H12O

MolecularWeight:

136.191

MdlNumber:

MFCD00128004

Smiles:

OCc1c(C)cccc1C

NscNumber:

618295

Complexity:

90.9

Covalently-bondedUnitCount:

1

HeavyAtomCount:

10

HydrogenBondAcceptorCount:

1

HydrogenBondDonorCount:

1

RotatableBondCount:

1

Xlogp3:

1.8

A2B Chem

--

CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

BrCc1ccc2c(c1)CCN(C2)C(=O)OC(C)(C)C

NscNumber:

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

A2B Chem

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CatalogNumber:

ChemicalName:

CasNumber:

MolecularFormula:

MolecularWeight:

MdlNumber:

Smiles:

NC(=O)C[C@@H]1NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)CCSSC[C@H](NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CCCNC(=N)N)Cc1ccc(cc1)O.CC(=O)O

NscNumber:

Complexity:

Covalently-bondedUnitCount:

HeavyAtomCount:

HydrogenBondAcceptorCount:

HydrogenBondDonorCount:

RotatableBondCount:

Xlogp3:

A2B Chem

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CatalogNumber:

AI53872

ChemicalName:

4-Aminobenzyl alcohol

CasNumber:

623-04-1

MolecularFormula:

C7H9NO

MolecularWeight:

123.1525

MdlNumber:

MFCD00014782

Smiles:

OCc1ccc(cc1)N

NscNumber:

__

Complexity:

77

Covalently-bondedUnitCount:

1

HeavyAtomCount:

9

HydrogenBondAcceptorCount:

2

HydrogenBondDonorCount:

2

RotatableBondCount:

1

Xlogp3:

-0.2