CS-0609513
2-Ethynyl-5-nitrobenzonitrile
Manufacturer: ChemScene
CAS Number: 1260794-78-2
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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([N+]([O-])=O)=CC=C1C#C
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
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: C₉H₄N₂O₂
Molecular Weight: 172.14
Synonyms: None
SMILES: N#CC1=CC([N+]([O-])=O)=CC=C1C#C
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([N+]([O-])=O)=CC=C1C#C
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: C₈H₆BrNO
Molecular Weight: 212.04
Synonyms: None
SMILES: COC1=NC=C(Br)C=C1C#C
Tpsa: 22.12
Logp: 1.834
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:
C₈H₆BrNO
Molecular Weight:
212.04
Synonyms:
None
SMILES:
COC1=NC=C(Br)C=C1C#C
Tpsa:
22.12
Logp:
1.834
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: C₇H₄BrNO
Molecular Weight: 198.02
Synonyms: 2(1H)-Pyridinone, 5-bromo-3-ethynyl-
SMILES: O=C1C(C#C)=CC(Br)=CN1
Tpsa: 32.86
Logp: 1.1187
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:
C₇H₄BrNO
Molecular Weight:
198.02
Synonyms:
2(1H)-Pyridinone, 5-bromo-3-ethynyl-
SMILES:
O=C1C(C#C)=CC(Br)=CN1
Tpsa:
32.86
Logp:
1.1187
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: C₉H₇NO
Molecular Weight: 145.16
Synonyms: 1-(6-ethynylpyridin-3-yl)ethanone
SMILES: CC(C1=CC=C(C#C)N=C1)=O
Tpsa: 29.96
Logp: 1.2655
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:
C₉H₇NO
Molecular Weight:
145.16
Synonyms:
1-(6-ethynylpyridin-3-yl)ethanone
SMILES:
CC(C1=CC=C(C#C)N=C1)=O
Tpsa:
29.96
Logp:
1.2655
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1