CS-1000863

Ibuprofen Impurity 36

Manufacturer: ChemScene

CAS Number: 126176-61-2

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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

C₁₈H₂₈O₃

Molecular Weight

292.41

Synonyms

None

SMILES

O=C(OCC(C)(C)CO)C(C1=CC=C(C=C1)CC(C)C)C

Tpsa

46.53

Logp

3.5503

H Acceptors

3

H Donors

1

Rotatable Bonds

7

SAFETY INFORMATION

ghsPictogramUrl

https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H315-H319-H335

Precautionary Statements

P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Img

ChemScene

CS-1000863

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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:
C₁₈H₂₈O₃

Molecular Weight:
292.41

Synonyms:
None

SMILES:
O=C(OCC(C)(C)CO)C(C1=CC=C(C=C1)CC(C)C)C

Tpsa:
46.53

Logp:
3.5503

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
7

Img

ChemScene

CS-1000864

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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:
C₈H₆Cl₂O₂

Molecular Weight:
205.04

Synonyms:
None

SMILES:
O=C(C1=CC(O)=CC=C1Cl)CCl

Tpsa:
37.3

Logp:
2.4671

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
2

Img

ChemScene

CS-1000868

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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:
C₁₆H₁₁F₂N₃

Molecular Weight:
283.28

Synonyms:
None

SMILES:
FC=1C=CC(=CC1)C2=NC(N)=CC(=N2)C=3C=CC(F)=CC3

Tpsa:
51.8

Logp:
3.671

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
2

Img

ChemScene

CS-1000869

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Purity:
≥95%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₂₀H₃₂F₂O₅

Molecular Weight:
390.46

Synonyms:
None

SMILES:
C(CCCC)(F)(F)[C@]1(O)O[C@]2([C@](CC1)([C@H](CCCCCCC(O)=O)C(=O)C2)[H])[H]

Tpsa:
83.83

Logp:
4.3099

H Acceptors:
4

H Donors:
2

Rotatable Bonds:
11