Catalog No.:AA00IN4B

691406-19-6 | 3-[3-(trifluoromethyl)benzyl]-2,4-pentanedione

Name: Name:3-[3-(trifluoromethyl)benzyl]-2,4-pentanedione
Brand: AABLOCKS
SKU: AA00IN4B
Rating: 90 (10 reviews)

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Purity

Availability

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Quantity

500mg

in stock

$1,162.00 $814.00

- +

in stock

$2,266.00 $1,586.00

- +

in stock

$8,888.00 $6,222.00

- +

Technical Information
Properties
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Technical Information

Catalog Number:

AA00IN4B

Chemical Name:

3-[3-(trifluoromethyl)benzyl]-2,4-pentanedione

CAS Number:

691406-19-6

Molecular Formula:

C13H13F3O2

Molecular Weight:

258.2363

MDL Number:

MFCD03102560

SMILES:

CC(=O)C(C(=O)C)Cc1cccc(c1)C(F)(F)F

Properties

Computed Properties

Complexity:

309

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Rotatable Bond Count:

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8

Literature

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Tags:691406-19-6 Molecular Formula|691406-19-6 MDL|691406-19-6 SMILES|691406-19-6 3-[3-(trifluoromethyl)benzyl]-2,4-pentanedione

Catalog No.: AA00IN4B

691406-19-6 | 3-[3-(trifluoromethyl)benzyl]-2,4-pentanedione

Pack Size： 500mg

Purity：

in stock

$1,162.00 $814.00

Pack Size： 1g

Purity：

in stock

$2,266.00 $1,586.00

Pack Size： 5g

Purity：

in stock

$8,888.00 $6,222.00

Quantity

- +

Add to Card

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Technical Information

Catalog Number: AA00IN4B

Chemical Name: 3-[3-(trifluoromethyl)benzyl]-2,4-pentanedione

CAS Number: 691406-19-6

Molecular Formula: C13H13F3O2

Molecular Weight: 258.2363

MDL Number: MFCD03102560

SMILES: CC(=O)C(C(=O)C)Cc1cccc(c1)C(F)(F)F

Properties

Complexity: 309

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 18

Hydrogen Bond Acceptor Count: 5

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 4

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.8

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