Home Products Building Blocks Functional Group CS 0900833

CS-0900833

Ethyl 2-cyano-4-(2-fluorophenyl)-4-oxobutanoate

Manufacturer: ChemScene

CAS Number: None

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Purity

98%

MDL No

None

Storage

Sealed in dry,2-8℃

Shipping

Room temperature in continental US; may vary elsewhere.

Molecular Formula

C₁₃H₁₂FNO₃

Molecular Weight

249.24

Synonyms

None

SMILES

O=C(C1=CC=CC=C1F)CC(C#N)C(OCC)=O

Tpsa

67.16

Logp

2.10138

H Acceptors

4

H Donors

0

Rotatable Bonds

5

Other Options

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SAFETY INFORMATION

Pictograms

Signal Word

N/A

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

Precautionary Statements

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ChemScene

--

Purity:

98%

MDL No:

None

Storage:

Sealed in dry,2-8℃

Shipping:

Room temperature in continental US; may vary elsewhere.

Molecular Formula:

C₁₃H₁₂FNO₃

Molecular Weight:

249.24

Synonyms:

None

SMILES:

O=C(C1=CC=CC=C1F)CC(C#N)C(OCC)=O

Tpsa:

67.16

Logp:

2.10138

H Acceptors:

4

H Donors:

0

Rotatable Bonds:

5

ChemScene

--

Purity:

98%

MDL No:

None

Storage:

4°C, sealed storage, away from moisture

Shipping:

Room temperature in continental US; may vary elsewhere.

Molecular Formula:

C₁₃H₁₆ClN

Molecular Weight:

221.73

Synonyms:

None

SMILES:

C#CC1=CC=C(C2CCNCC2)C=C1.Cl

Tpsa:

12.03

Logp:

2.5567

H Acceptors:

1

H Donors:

1

Rotatable Bonds:

1

ChemScene

--

Purity:

98%

MDL No:

None

Storage:

Sealed in dry,2-8℃

Shipping:

Room temperature in continental US; may vary elsewhere.

Molecular Formula:

C₁₀H₁₂O₁₀S₂

Molecular Weight:

356.33

Synonyms:

Chromotropic acid (dihydrate)

SMILES:

O=S(C1=CC(O)=C2C(O)=CC(S(=O)(O)=O)=CC2=C1)(O)=O.O.O

Tpsa:

212.2

Logp:

-0.905

H Acceptors:

6

H Donors:

4

Rotatable Bonds:

2

ChemScene

--

Purity:

98%

MDL No:

None

Storage:

Sealed in dry,2-8℃

Shipping:

Room temperature in continental US; may vary elsewhere.

Molecular Formula:

C₂₀H₂₂Cl₃N₃O₄S

Molecular Weight:

506.83

Synonyms:

None

SMILES:

ClC1=C(C=CC=C1Cl)SC2=C(N=C(C=N2)Cl)N(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O

Tpsa:

81.62

Logp:

7.2646

H Acceptors:

7

H Donors:

0

Rotatable Bonds:

3