AE61958

1214323-23-5 | 2-Chloro-5-phenylisonicotinic acid

Manufacturer: A2B Chem

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CatalogNumber

AE61958

ChemicalName

2-Chloro-5-phenylisonicotinic acid

CasNumber

1214323-23-5

MolecularFormula

C12H8ClNO2

MolecularWeight

233.6504

MdlNumber

MFCD14701690

Smiles

Clc1ncc(c(c1)C(=O)O)c1ccccc1

Complexity

253

Covalently-bondedUnitCount

1

HeavyAtomCount

16

HydrogenBondAcceptorCount

3

HydrogenBondDonorCount

1

RotatableBondCount

2

Xlogp3

3

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A2B Chem

AE61958

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CatalogNumber:
AE61958

ChemicalName:
2-Chloro-5-phenylisonicotinic acid

CasNumber:
1214323-23-5

MolecularFormula:
C12H8ClNO2

MolecularWeight:
233.6504

MdlNumber:
MFCD14701690

Smiles:
Clc1ncc(c(c1)C(=O)O)c1ccccc1

Complexity:
253

Covalently-bondedUnitCount:
1

HeavyAtomCount:
16

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
1

RotatableBondCount:
2

Xlogp3:
3

Img

A2B Chem

AE61959

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CatalogNumber:
AE61959

ChemicalName:
2-Chloro-4-(3-chlorophenyl)benzonitrile

CasNumber:
1355247-47-0

MolecularFormula:
C13H7Cl2N

MolecularWeight:
248.1074

MdlNumber:
MFCD21333014

Smiles:
N#Cc1ccc(cc1Cl)c1cccc(c1)Cl

Complexity:
283

Covalently-bondedUnitCount:
1

HeavyAtomCount:
16

HydrogenBondAcceptorCount:
1

HydrogenBondDonorCount:
__

RotatableBondCount:
1

Xlogp3:
4.5

Img

A2B Chem

AE61960

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CatalogNumber:
AE61960

ChemicalName:
4-Bromo-1-fluoro-2-(piperidinomethyl)benzene

CasNumber:
1345471-85-3

MolecularFormula:
C12H15BrFN

MolecularWeight:
272.1566

MdlNumber:
MFCD20441944

Smiles:
Fc1ccc(cc1CN1CCCCC1)Br

Complexity:
194

Covalently-bondedUnitCount:
1

HeavyAtomCount:
15

HydrogenBondAcceptorCount:
2

HydrogenBondDonorCount:
__

RotatableBondCount:
2

Xlogp3:
3.4

Img

A2B Chem

AE61961

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CCOc1cccc(c1)c1ccc(cc1)C(=O)OC

Complexity:
282

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
3.7