AG68078

57905-31-4 | Ethyl 4-hydroxynicotinate

Manufacturer: A2B Chem

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CatalogNumber

AG68078

ChemicalName

Ethyl 4-hydroxynicotinate

CasNumber

57905-31-4

MolecularFormula

C8H9NO3

MolecularWeight

167.162

MdlNumber

MFCD00234426

Smiles

CCOC(=O)c1cnccc1O

Complexity

266

Covalently-bondedUnitCount

1

HeavyAtomCount

12

HydrogenBondAcceptorCount

4

HydrogenBondDonorCount

1

RotatableBondCount

3

Xlogp3

0.6

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A2B Chem

AG68078

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CatalogNumber:
AG68078

ChemicalName:
Ethyl 4-hydroxynicotinate

CasNumber:
57905-31-4

MolecularFormula:
C8H9NO3

MolecularWeight:
167.162

MdlNumber:
MFCD00234426

Smiles:
CCOC(=O)c1cnccc1O

Complexity:
266

Covalently-bondedUnitCount:
1

HeavyAtomCount:
12

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
1

RotatableBondCount:
3

Xlogp3:
0.6

Img

A2B Chem

AG68079

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CatalogNumber:
AG68079

ChemicalName:
Methyl 3-bromo-5-nitrobenzoate

CasNumber:
6307-87-5

MolecularFormula:
C8H6BrNO4

MolecularWeight:
260.0415

MdlNumber:
MFCD09258759

Smiles:
COC(=O)c1cc(Br)cc(c1)[N+](=O)[O-]

Complexity:
240

Covalently-bondedUnitCount:
1

HeavyAtomCount:
14

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
__

RotatableBondCount:
2

Xlogp3:
2.7

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A2B Chem

AG68080

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CatalogNumber:
AG68080

ChemicalName:
3-Bromo-N-(2-hydroxyethyl)benzamide

CasNumber:
57728-66-2

MolecularFormula:
C9H10BrNO2

MolecularWeight:
244.0852

MdlNumber:
MFCD01249209

Smiles:
OCCNC(=O)c1cccc(c1)Br

Complexity:
175

Covalently-bondedUnitCount:
1

HeavyAtomCount:
13

HydrogenBondAcceptorCount:
2

HydrogenBondDonorCount:
2

RotatableBondCount:
3

Xlogp3:
1.3

Img

A2B Chem

AG68081

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CatalogNumber:
AG68081

ChemicalName:
2,6-Dichloro-3-methylpyridine

CasNumber:
58584-94-4

MolecularFormula:
C6H5Cl2N

MolecularWeight:
162.0166

MdlNumber:
MFCD00137847

Smiles:
Clc1ccc(c(n1)Cl)C

Complexity:
97.1

Covalently-bondedUnitCount:
1

HeavyAtomCount:
9

HydrogenBondAcceptorCount:
1

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
3.1