CS-0611503
4-Ethynyl-3-nitrobenzonitrile
Manufacturer: ChemScene
CAS Number: 914105-97-8
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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
C₉H₄N₂O₂
Molecular Weight
172.14
Synonyms
None
SMILES
N#CC1=CC=C(C#C)C([N+]([O-])=O)=C1
Tpsa
66.93
Logp
1.44778
H Acceptors
3
H Donors
0
Rotatable Bonds
1
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₄N₂O₂
Molecular Weight: 172.14
Synonyms: None
SMILES: N#CC1=CC=C(C#C)C([N+]([O-])=O)=C1
Tpsa: 66.93
Logp: 1.44778
H Acceptors: 3
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:
C₉H₄N₂O₂
Molecular Weight:
172.14
Synonyms:
None
SMILES:
N#CC1=CC=C(C#C)C([N+]([O-])=O)=C1
Tpsa:
66.93
Logp:
1.44778
H Acceptors:
3
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: C₉H₄ClN
Molecular Weight: 161.59
Synonyms: None
SMILES: N#CC1=CC=C(C#C)C(Cl)=C1
Tpsa: 23.79
Logp: 2.19298
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:
C₉H₄ClN
Molecular Weight:
161.59
Synonyms:
None
SMILES:
N#CC1=CC=C(C#C)C(Cl)=C1
Tpsa:
23.79
Logp:
2.19298
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: C₉H₄ClN
Molecular Weight: 161.59
Synonyms: None
SMILES: ClC1=CC=C(C#N)C=C1C#C
Tpsa: 23.79
Logp: 2.19298
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:
C₉H₄ClN
Molecular Weight:
161.59
Synonyms:
None
SMILES:
ClC1=CC=C(C#N)C=C1C#C
Tpsa:
23.79
Logp:
2.19298
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: C₉H₉N
Molecular Weight: 131.17
Synonyms: None
SMILES: CNC1=CC=CC=C1C#C
Tpsa: 12.03
Logp: 1.7096
H Acceptors: 1
H Donors: 1
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:
C₉H₉N
Molecular Weight:
131.17
Synonyms:
None
SMILES:
CNC1=CC=CC=C1C#C
Tpsa:
12.03
Logp:
1.7096
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1