CS-1075494
Tert-butyl 4-ethynyl-3,5-dimethyl-1H-pyrazole-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2680700-60-9
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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
C₁₂H₁₆N₂O₂
Molecular Weight
220.27
Synonyms
None
SMILES
O=C(OC(C)(C)C)N1N=C(C(C#C)=C1C)C
Tpsa
44.12
Logp
2.26444
H Acceptors
4
H Donors
0
Rotatable Bonds
0
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: C₁₂H₁₆N₂O₂
Molecular Weight: 220.27
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1N=C(C(C#C)=C1C)C
Tpsa: 44.12
Logp: 2.26444
H Acceptors: 4
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:
C₁₂H₁₆N₂O₂
Molecular Weight:
220.27
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1N=C(C(C#C)=C1C)C
Tpsa:
44.12
Logp:
2.26444
H Acceptors:
4
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: C₉H₁₄FNO₃
Molecular Weight: 203.21
Synonyms: None
SMILES: O=C(OCC=C)N1CC(OCCF)C1
Tpsa: 38.77
Logp: 0.9793
H Acceptors: 3
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:
C₉H₁₄FNO₃
Molecular Weight:
203.21
Synonyms:
None
SMILES:
O=C(OCC=C)N1CC(OCCF)C1
Tpsa:
38.77
Logp:
0.9793
H Acceptors:
3
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: C₁₆H₁₆N₂O₄
Molecular Weight: 300.31
Synonyms: None
SMILES: O=C(O)C1=CC(=CN1CC=2C=CC=CC2)NC(=O)OCC=C
Tpsa: 80.56
Logp: 2.9691
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₆N₂O₄
Molecular Weight:
300.31
Synonyms:
None
SMILES:
O=C(O)C1=CC(=CN1CC=2C=CC=CC2)NC(=O)OCC=C
Tpsa:
80.56
Logp:
2.9691
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇N₃O₂
Molecular Weight: 259.30
Synonyms: None
SMILES: N#CC1(N(C)C)CN(C(=O)OCC=2C=CC=CC2)C1
Tpsa: 56.57
Logp: 1.46278
H Acceptors: 4
H Donors: 0
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:
C₁₄H₁₇N₃O₂
Molecular Weight:
259.30
Synonyms:
None
SMILES:
N#CC1(N(C)C)CN(C(=O)OCC=2C=CC=CC2)C1
Tpsa:
56.57
Logp:
1.46278
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3