CS-0874817
1-(3-Cyanopropyl)-3-methyl-1h-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide
Manufacturer: ChemScene
CAS Number: 778593-18-3
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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
C₁₀H₁₂F₆N₄O₄S₂
Molecular Weight
430.35
Synonyms
None
SMILES
C[N+]1=CN(C=C1)CCCC#N.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
Tpsa
114.98
Logp
1.67568
H Acceptors
6
H Donors
0
Rotatable Bonds
5
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-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: C₁₀H₁₂F₆N₄O₄S₂
Molecular Weight: 430.35
Synonyms: None
SMILES: C[N+]1=CN(C=C1)CCCC#N.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
Tpsa: 114.98
Logp: 1.67568
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂F₆N₄O₄S₂
Molecular Weight:
430.35
Synonyms:
None
SMILES:
C[N+]1=CN(C=C1)CCCC#N.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
Tpsa:
114.98
Logp:
1.67568
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉N₃O₇
Molecular Weight: 271.18
Synonyms: None
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C[C@H](C(=O)O)N
Tpsa: 169.83
Logp: 0.163
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉N₃O₇
Molecular Weight:
271.18
Synonyms:
None
SMILES:
C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C[C@H](C(=O)O)N
Tpsa:
169.83
Logp:
0.163
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₃Br
Molecular Weight: 247.22
Synonyms: None
SMILES: C1CCCCCC(CCCCC1)Br
Tpsa: 0
Logp: 5.0546
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₃Br
Molecular Weight:
247.22
Synonyms:
None
SMILES:
C1CCCCCC(CCCCC1)Br
Tpsa:
0
Logp:
5.0546
H Acceptors:
0
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: C₁₂H₁₅NO₆
Molecular Weight: 269.25
Synonyms: None
SMILES: CC1=C(C(=C(N1)OC(=O)C)CC(=O)OC)C(=O)OC
Tpsa: 94.69
Logp: 0.75052
H Acceptors: 6
H Donors: 1
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:
C₁₂H₁₅NO₆
Molecular Weight:
269.25
Synonyms:
None
SMILES:
CC1=C(C(=C(N1)OC(=O)C)CC(=O)OC)C(=O)OC
Tpsa:
94.69
Logp:
0.75052
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
4