CS-0768189
3,5-Dimethyl-4-Nitrobenzonitrile
Manufacturer: ChemScene
CAS Number: 101552-39-0
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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
C₉H₈N₂O₂
Molecular Weight
176.17
Synonyms
None
SMILES
CC1=CC(=CC(C)=C1[N+]([O-])=O)C#N
Tpsa
66.93
Logp
2.08332
H Acceptors
3
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
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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: C₉H₈N₂O₂
Molecular Weight: 176.17
Synonyms: None
SMILES: CC1=CC(=CC(C)=C1[N+]([O-])=O)C#N
Tpsa: 66.93
Logp: 2.08332
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈N₂O₂
Molecular Weight:
176.17
Synonyms:
None
SMILES:
CC1=CC(=CC(C)=C1[N+]([O-])=O)C#N
Tpsa:
66.93
Logp:
2.08332
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₅NSi
Molecular Weight: 225.36
Synonyms: None
SMILES: C[Si](C)(C)C#CC1=CC=NC2=CC=CC=C12
Tpsa: 12.89
Logp: 3.4637
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₅NSi
Molecular Weight:
225.36
Synonyms:
None
SMILES:
C[Si](C)(C)C#CC1=CC=NC2=CC=CC=C12
Tpsa:
12.89
Logp:
3.4637
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₆FNO
Molecular Weight: 127.12
Synonyms: None
SMILES: CC1=C(F)C=CC(=O)N1
Tpsa: 32.86
Logp: 0.82242
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₆FNO
Molecular Weight:
127.12
Synonyms:
None
SMILES:
CC1=C(F)C=CC(=O)N1
Tpsa:
32.86
Logp:
0.82242
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₆IN₃O₂
Molecular Weight: 279.04
Synonyms: None
SMILES: NC1=C(N)C=C(C(I)=C1)[N+]([O-])=O
Tpsa: 95.18
Logp: 1.3638
H Acceptors: 4
H Donors: 2
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:
C₆H₆IN₃O₂
Molecular Weight:
279.04
Synonyms:
None
SMILES:
NC1=C(N)C=C(C(I)=C1)[N+]([O-])=O
Tpsa:
95.18
Logp:
1.3638
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1