AB44245

621-54-5 | 3-(3-Hydroxyphenyl)propionic acid

Manufacturer: A2B Chem

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CatalogNumber

AB44245

ChemicalName

3-(3-Hydroxyphenyl)propionic acid

CasNumber

621-54-5

MolecularFormula

C9H10O3

MolecularWeight

166.1739

MdlNumber

MFCD00016554

Smiles

OC(=O)CCc1cccc(c1)O

Complexity

156

Covalently-bondedUnitCount

1

HeavyAtomCount

12

HydrogenBondAcceptorCount

3

HydrogenBondDonorCount

2

RotatableBondCount

3

Xlogp3

1.4

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A2B Chem

AB44245

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CatalogNumber:
AB44245

ChemicalName:
3-(3-Hydroxyphenyl)propionic acid

CasNumber:
621-54-5

MolecularFormula:
C9H10O3

MolecularWeight:
166.1739

MdlNumber:
MFCD00016554

Smiles:
OC(=O)CCc1cccc(c1)O

Complexity:
156

Covalently-bondedUnitCount:
1

HeavyAtomCount:
12

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
2

RotatableBondCount:
3

Xlogp3:
1.4

Img

A2B Chem

AB44246

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AB44247

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CatalogNumber:
AB44247

ChemicalName:
3-(4-Bromobenzoyl)propionic acid

CasNumber:
6340-79-0

MolecularFormula:
C10H9BrO3

MolecularWeight:
257.0807

MdlNumber:
MFCD00016563

Smiles:
O=C(c1ccc(cc1)Br)CCC(=O)O

Complexity:
219

Covalently-bondedUnitCount:
1

HeavyAtomCount:
14

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
1

RotatableBondCount:
4

Xlogp3:
2.1

Img

A2B Chem

AB44248

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
O=C1CC(C1)c1ccc(cc1)Br

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__