CS-0851661

3-(4-Acetylpiperazin-1-yl)benzonitrile

Manufacturer: ChemScene

CAS Number: 1500989-31-0

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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

C₁₃H₁₅N₃O

Molecular Weight

229.28

Synonyms

None

SMILES

CC(=O)N1CCN(C2=CC(C#N)=CC=C2)CC1

Tpsa

47.34

Logp

1.22678

H Acceptors

3

H Donors

0

Rotatable Bonds

1

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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Img

ChemScene

CS-0851661

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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:
C₁₃H₁₅N₃O

Molecular Weight:
229.28

Synonyms:
None

SMILES:
CC(=O)N1CCN(C2=CC(C#N)=CC=C2)CC1

Tpsa:
47.34

Logp:
1.22678

H Acceptors:
3

H Donors:
0

Rotatable Bonds:
1

Img

ChemScene

CS-0851663

--


Purity:
97%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₁₈H₁₇NO₄

Molecular Weight:
311.33

Synonyms:
None

SMILES:
O=C(O)[C@@H]1C2=CC=CC=C2CCN1C(=O)OCC1=CC=CC=C1

Tpsa:
66.84

Logp:
3.0072

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
3

Img

ChemScene

CS-0851664

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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:
C₁₂H₉F₃N₂O₃S

Molecular Weight:
318.27

Synonyms:
None

SMILES:
CC1=C(C(=O)O)SC(NC2=CC=C(OC(F)(F)F)C=C2)=N1

Tpsa:
71.45

Logp:
3.79192

H Acceptors:
5

H Donors:
2

Rotatable Bonds:
4

Img

ChemScene

CS-0851665

--


Purity:
95%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₈H₉F₂NO

Molecular Weight:
173.16

Synonyms:
None

SMILES:
NC1=CC=C(OCCF)C=C1F

Tpsa:
35.25

Logp:
1.7562

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
3