CS-0886912
2-Acetyl-4-methylbenzonitrile
Manufacturer: ChemScene
CAS Number: 1822768-51-3
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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
C₁₀H₉NO
Molecular Weight
159.18
Synonyms
None
SMILES
N#CC1=CC=C(C)C=C1C(C)=O
Tpsa
40.86
Logp
2.0693
H Acceptors
2
H Donors
0
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
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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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₉NO
Molecular Weight: 159.18
Synonyms: None
SMILES: N#CC1=CC=C(C)C=C1C(C)=O
Tpsa: 40.86
Logp: 2.0693
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₉NO
Molecular Weight:
159.18
Synonyms:
None
SMILES:
N#CC1=CC=C(C)C=C1C(C)=O
Tpsa:
40.86
Logp:
2.0693
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂F₃NO₅S
Molecular Weight: 351.30
Synonyms: None
SMILES: O=C(N1CCC(OS(=O)(C(F)(F)F)=O)=C1)OCC2=CC=CC=C2
Tpsa: 72.91
Logp: 2.7365
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂F₃NO₅S
Molecular Weight:
351.30
Synonyms:
None
SMILES:
O=C(N1CCC(OS(=O)(C(F)(F)F)=O)=C1)OCC2=CC=CC=C2
Tpsa:
72.91
Logp:
2.7365
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆ClNO
Molecular Weight: 179.60
Synonyms: None
SMILES: N#CC1=CC=C(Cl)C=C1C(C)=O
Tpsa: 40.86
Logp: 2.41428
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆ClNO
Molecular Weight:
179.60
Synonyms:
None
SMILES:
N#CC1=CC=C(Cl)C=C1C(C)=O
Tpsa:
40.86
Logp:
2.41428
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₅F₂NO
Molecular Weight: 181.14
Synonyms: None
SMILES: N#CC1=C(F)C=C(C(C)=O)C=C1F
Tpsa: 40.86
Logp: 2.03908
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₅F₂NO
Molecular Weight:
181.14
Synonyms:
None
SMILES:
N#CC1=C(F)C=C(C(C)=O)C=C1F
Tpsa:
40.86
Logp:
2.03908
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1