CS-0636342
tert-Butyl 2-(1H-pyrazol-4-yl)acetate
Manufacturer: ChemScene
CAS Number: 2384664-80-4
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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
C₉H₁₄N₂O₂
Molecular Weight
182.22
Synonyms
None
SMILES
O=C(OC(C)(C)C)CC1=CNN=C1
Tpsa
54.98
Logp
1.2939
H Acceptors
3
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: C₉H₁₄N₂O₂
Molecular Weight: 182.22
Synonyms: None
SMILES: O=C(OC(C)(C)C)CC1=CNN=C1
Tpsa: 54.98
Logp: 1.2939
H Acceptors: 3
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:
C₉H₁₄N₂O₂
Molecular Weight:
182.22
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)CC1=CNN=C1
Tpsa:
54.98
Logp:
1.2939
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉N₃O
Molecular Weight: 175.19
Synonyms: None
SMILES: O=C1N(C2=NC=CC=C2)N=C(C)C1
Tpsa: 45.56
Logp: 1.1942
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉N₃O
Molecular Weight:
175.19
Synonyms:
None
SMILES:
O=C1N(C2=NC=CC=C2)N=C(C)C1
Tpsa:
45.56
Logp:
1.1942
H Acceptors:
3
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: C₃H₆ClF₂NO₂
Molecular Weight: 161.54
Synonyms: None
SMILES: N[C@H](C(F)F)C(O)=O.[H]Cl
Tpsa: 63.32
Logp: 0.0852
H Acceptors: 2
H Donors: 2
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:
C₃H₆ClF₂NO₂
Molecular Weight:
161.54
Synonyms:
None
SMILES:
N[C@H](C(F)F)C(O)=O.[H]Cl
Tpsa:
63.32
Logp:
0.0852
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: 4°C, stored under nitrogen, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₅NO₄
Molecular Weight: 271.35
Synonyms: None
SMILES: O=C(NCCCOCCCOCC#C)OC(C)(C)C
Tpsa: 56.79
Logp: 1.9577
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 9
Purity:
97%
MDL No:
None
Storage:
4°C, stored under nitrogen, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₅NO₄
Molecular Weight:
271.35
Synonyms:
None
SMILES:
O=C(NCCCOCCCOCC#C)OC(C)(C)C
Tpsa:
56.79
Logp:
1.9577
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
9