CS-0948066
Tert-butyl 3-fluoro-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)pyrrolidine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 1454687-08-1
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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
C₁₈H₂₉BFN₃O₄
Molecular Weight
381.25
Synonyms
None
SMILES
O=C(OC(C)(C)C)N1CC(F)C(N2N=CC(=C2)B3OC(C)(C)C(O3)(C)C)C1
Tpsa
65.82
Logp
2.3122
H Acceptors
6
H Donors
0
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
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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: C₁₈H₂₉BFN₃O₄
Molecular Weight: 381.25
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CC(F)C(N2N=CC(=C2)B3OC(C)(C)C(O3)(C)C)C1
Tpsa: 65.82
Logp: 2.3122
H Acceptors: 6
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:
C₁₈H₂₉BFN₃O₄
Molecular Weight:
381.25
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CC(F)C(N2N=CC(=C2)B3OC(C)(C)C(O3)(C)C)C1
Tpsa:
65.82
Logp:
2.3122
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁NO₃S
Molecular Weight: 189.23
Synonyms: None
SMILES: O=S1(=O)NC2C(O)C3CC2C1C3
Tpsa: 66.4
Logp: -0.9427
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₁NO₃S
Molecular Weight:
189.23
Synonyms:
None
SMILES:
O=S1(=O)NC2C(O)C3CC2C1C3
Tpsa:
66.4
Logp:
-0.9427
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁N₃O
Molecular Weight: 177.20
Synonyms: None
SMILES: OCCN1N=C2C=C(N)C=CC2=C1
Tpsa: 64.07
Logp: 0.6108
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁N₃O
Molecular Weight:
177.20
Synonyms:
None
SMILES:
OCCN1N=C2C=C(N)C=CC2=C1
Tpsa:
64.07
Logp:
0.6108
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₇F₃N₂O
Molecular Weight: 192.14
Synonyms: None
SMILES: FC(F)(F)C1=NC=C(C(=N1)C)CO
Tpsa: 46.01
Logp: 1.29612
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₇F₃N₂O
Molecular Weight:
192.14
Synonyms:
None
SMILES:
FC(F)(F)C1=NC=C(C(=N1)C)CO
Tpsa:
46.01
Logp:
1.29612
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1