CS-0876922
4-Cyano-1-(2-ethoxy-2-oxoethyl)pyridin-1-ium bromide
Manufacturer: ChemScene
CAS Number: 15591-99-8
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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
C₁₀H₁₁BrN₂O₂
Molecular Weight
271.11
Synonyms
None
SMILES
O=C(OCC)C[N+]1=CC=C(C#N)C=C1.[Br-]
Tpsa
53.97
Logp
-2.58712
H Acceptors
3
H Donors
0
Rotatable Bonds
3
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: C₁₀H₁₁BrN₂O₂
Molecular Weight: 271.11
Synonyms: None
SMILES: O=C(OCC)C[N+]1=CC=C(C#N)C=C1.[Br-]
Tpsa: 53.97
Logp: -2.58712
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁BrN₂O₂
Molecular Weight:
271.11
Synonyms:
None
SMILES:
O=C(OCC)C[N+]1=CC=C(C#N)C=C1.[Br-]
Tpsa:
53.97
Logp:
-2.58712
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀N₂O₃
Molecular Weight: 218.21
Synonyms: None
SMILES: N#CC1=CC=C(C(NC(C)C(O)=O)=O)C=C1
Tpsa: 90.19
Logp: 0.76118
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀N₂O₃
Molecular Weight:
218.21
Synonyms:
None
SMILES:
N#CC1=CC=C(C(NC(C)C(O)=O)=O)C=C1
Tpsa:
90.19
Logp:
0.76118
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₉ClF₂OS₃
Molecular Weight: 314.82
Synonyms: None
SMILES: CCOC(=S)SC(F)(F)SC1=CC=C(C=C1)Cl
Tpsa: 9.23
Logp: 5.037
H Acceptors: 4
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:
C₁₀H₉ClF₂OS₃
Molecular Weight:
314.82
Synonyms:
None
SMILES:
CCOC(=S)SC(F)(F)SC1=CC=C(C=C1)Cl
Tpsa:
9.23
Logp:
5.037
H Acceptors:
4
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: C₁₀H₁₃BrN₂
Molecular Weight: 241.13
Synonyms: None
SMILES: BrC1=C(N2CCCCC2)C=NC=C1
Tpsa: 16.13
Logp: 2.8344
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:
C₁₀H₁₃BrN₂
Molecular Weight:
241.13
Synonyms:
None
SMILES:
BrC1=C(N2CCCCC2)C=NC=C1
Tpsa:
16.13
Logp:
2.8344
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1