CS-1053325
4-(3-Butyn-1-yl)-3-(trifluoromethyl)-1H-pyrazole
Manufacturer: ChemScene
CAS Number: 2229512-24-5
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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
C₈H₇F₃N₂
Molecular Weight
188.15
Synonyms
None
SMILES
FC(C1=NNC=C1CCC#C)(F)F
Tpsa
28.68
Logp
1.9943
H Acceptors
1
H Donors
1
Rotatable Bonds
2
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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: C₈H₇F₃N₂
Molecular Weight: 188.15
Synonyms: None
SMILES: FC(C1=NNC=C1CCC#C)(F)F
Tpsa: 28.68
Logp: 1.9943
H Acceptors: 1
H Donors: 1
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:
C₈H₇F₃N₂
Molecular Weight:
188.15
Synonyms:
None
SMILES:
FC(C1=NNC=C1CCC#C)(F)F
Tpsa:
28.68
Logp:
1.9943
H Acceptors:
1
H Donors:
1
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: C₁₆H₂₀BNO₃
Molecular Weight: 285.15
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CC=CC3=C2C=CN=C3OC)O1
Tpsa: 40.58
Logp: 2.5426
H Acceptors: 4
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:
C₁₆H₂₀BNO₃
Molecular Weight:
285.15
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CC=CC3=C2C=CN=C3OC)O1
Tpsa:
40.58
Logp:
2.5426
H Acceptors:
4
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: C₁₁H₁₉NO₄
Molecular Weight: 229.27
Synonyms: None
SMILES: O=C(OC(C)(C)C)NCC1(CO)CC(C1)=O
Tpsa: 75.63
Logp: 0.8527
H Acceptors: 4
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:
C₁₁H₁₉NO₄
Molecular Weight:
229.27
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NCC1(CO)CC(C1)=O
Tpsa:
75.63
Logp:
0.8527
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₇BrOS
Molecular Weight: 219.10
Synonyms: None
SMILES: CC(C1=C(C)SC(Br)=C1)=O
Tpsa: 17.07
Logp: 3.02162
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₇BrOS
Molecular Weight:
219.10
Synonyms:
None
SMILES:
CC(C1=C(C)SC(Br)=C1)=O
Tpsa:
17.07
Logp:
3.02162
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1