CS-1059061

2-(5-(Tert-butyl)-2-methylphenyl)acetonitrile

Manufacturer: ChemScene

CAS Number: 858004-36-1

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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

C₁₃H₁₇N

Molecular Weight

187.28

Synonyms

None

SMILES

N#CCC1=CC(=CC=C1C)C(C)(C)C

Tpsa

23.79

Logp

3.3586

H Acceptors

1

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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ChemScene

CS-1059061

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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:
C₁₃H₁₇N

Molecular Weight:
187.28

Synonyms:
None

SMILES:
N#CCC1=CC(=CC=C1C)C(C)(C)C

Tpsa:
23.79

Logp:
3.3586

H Acceptors:
1

H Donors:
0

Rotatable Bonds:
1

Img

ChemScene

CS-1059062

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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:
C₆H₆N₄S

Molecular Weight:
166.20

Synonyms:
None

SMILES:
N1=CC(N)=CC=2N=C(SC12)N

Tpsa:
77.82

Logp:
0.8557

H Acceptors:
5

H Donors:
2

Rotatable Bonds:
0

Img

ChemScene

CS-1059063

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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:
C₆H₆N₄OS₂

Molecular Weight:
214.27

Synonyms:
None

SMILES:
O=C1NC(=S)NC=2N=C(SC12)NC

Tpsa:
73.57

Logp:
1.08389

H Acceptors:
5

H Donors:
3

Rotatable Bonds:
1

Img

ChemScene

CS-1059064

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₅H₄N₄S

Molecular Weight:
152.18

Synonyms:
None

SMILES:
N=1C=NC=2N=C(SC2C1)N

Tpsa:
64.69

Logp:
0.6685

H Acceptors:
5

H Donors:
1

Rotatable Bonds:
0