CS-0886937
2-Acetyl-6-methylbenzonitrile
Manufacturer: ChemScene
CAS Number: 1363508-04-6
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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=C(C)C=CC=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=C(C)C=CC=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=C(C)C=CC=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: C₈H₁₈ClNO₂S
Molecular Weight: 227.75
Synonyms: None
SMILES: CS(=O)([C@@H]1CC[C@H](CC1)CN)=O.Cl
Tpsa: 60.16
Logp: 0.9703
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₈ClNO₂S
Molecular Weight:
227.75
Synonyms:
None
SMILES:
CS(=O)([C@@H]1CC[C@H](CC1)CN)=O.Cl
Tpsa:
60.16
Logp:
0.9703
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₈ClNO₃S
Molecular Weight: 243.75
Synonyms: None
SMILES: CS(=O)([C@H]1C[C@H]([C@@H](CC1)CN)O)=O.Cl
Tpsa: 80.39
Logp: -0.0589
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₈ClNO₃S
Molecular Weight:
243.75
Synonyms:
None
SMILES:
CS(=O)([C@H]1C[C@H]([C@@H](CC1)CN)O)=O.Cl
Tpsa:
80.39
Logp:
-0.0589
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₇ClN₂O₂S
Molecular Weight: 252.76
Synonyms: None
SMILES: NC[C@]1(CC[C@@H](CC1)S(C)(=O)=O)C#N.Cl
Tpsa: 83.95
Logp: 0.86408
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₇ClN₂O₂S
Molecular Weight:
252.76
Synonyms:
None
SMILES:
NC[C@]1(CC[C@@H](CC1)S(C)(=O)=O)C#N.Cl
Tpsa:
83.95
Logp:
0.86408
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2