CS-1059035

5-Octylisoxazole-3-carboxylic acid

Manufacturer: ChemScene

CAS Number: 858489-65-3

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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

C₁₂H₁₉NO₃

Molecular Weight

225.28

Synonyms

None

SMILES

O=C(O)C1=NOC(=C1)CCCCCCCC

Tpsa

63.33

Logp

3.2758

H Acceptors

3

H Donors

1

Rotatable Bonds

8

SAFETY INFORMATION

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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ChemScene

CS-1059035

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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:
C₁₂H₁₉NO₃

Molecular Weight:
225.28

Synonyms:
None

SMILES:
O=C(O)C1=NOC(=C1)CCCCCCCC

Tpsa:
63.33

Logp:
3.2758

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
8

Img

ChemScene

CS-1059036

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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:
C₁₀H₁₀N₂O₂

Molecular Weight:
190.20

Synonyms:
None

SMILES:
N1=CC=NC=2C1=CC(OC)=CC2OC

Tpsa:
44.24

Logp:
1.647

H Acceptors:
4

H Donors:
0

Rotatable Bonds:
2

Img

ChemScene

CS-1059037

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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:
C₁₁H₉Cl₂N

Molecular Weight:
226.10

Synonyms:
None

SMILES:
ClC=1N=C2C=C(Cl)C(=CC2=C(C1)C)C

Tpsa:
12.89

Logp:
4.15844

H Acceptors:
1

H Donors:
0

Rotatable Bonds:
0

Img

ChemScene

CS-1059038

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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:
C₁₀H₈Cl₂N₂

Molecular Weight:
227.09

Synonyms:
None

SMILES:
ClC=1N=C2C(=CC1)C(N)=C(Cl)C=C2C

Tpsa:
38.91

Logp:
3.43222

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
0