CS-0594319
1-(3-(Trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 681470-19-9
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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
C₆H₃F₃N₄OS
Molecular Weight
236.17
Synonyms
None
SMILES
CC(C1=NN2C(S1)=NN=C2C(F)(F)F)=O
Tpsa
60.15
Logp
1.4072
H Acceptors
6
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: C₆H₃F₃N₄OS
Molecular Weight: 236.17
Synonyms: None
SMILES: CC(C1=NN2C(S1)=NN=C2C(F)(F)F)=O
Tpsa: 60.15
Logp: 1.4072
H Acceptors: 6
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:
C₆H₃F₃N₄OS
Molecular Weight:
236.17
Synonyms:
None
SMILES:
CC(C1=NN2C(S1)=NN=C2C(F)(F)F)=O
Tpsa:
60.15
Logp:
1.4072
H Acceptors:
6
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: C₆H₅N₃O₆
Molecular Weight: 215.12
Synonyms: None
SMILES: C1=C(C(=O)NC(=O)N1CC(=O)O)[N+](=O)[O-]
Tpsa: 135.3
Logp: -1.4706
H Acceptors: 6
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:
C₆H₅N₃O₆
Molecular Weight:
215.12
Synonyms:
None
SMILES:
C1=C(C(=O)NC(=O)N1CC(=O)O)[N+](=O)[O-]
Tpsa:
135.3
Logp:
-1.4706
H Acceptors:
6
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: C₈H₈N₂O₃
Molecular Weight: 180.16
Synonyms: None
SMILES: C1=CN(C=C1)NC(=O)C=CC(=O)O
Tpsa: 71.33
Logp: 0.199
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:
C₈H₈N₂O₃
Molecular Weight:
180.16
Synonyms:
None
SMILES:
C1=CN(C=C1)NC(=O)C=CC(=O)O
Tpsa:
71.33
Logp:
0.199
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: C₇H₈BrNO
Molecular Weight: 202.05
Synonyms: None
SMILES: CN1C=CC=C1C(=O)CBr
Tpsa: 22
Logp: 1.6027
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈BrNO
Molecular Weight:
202.05
Synonyms:
None
SMILES:
CN1C=CC=C1C(=O)CBr
Tpsa:
22
Logp:
1.6027
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2