CS-0564411
Methyl 2-((tert-butoxycarbonyl)amino)-2-(trifluoromethyl)pent-4-ynoate
Manufacturer: ChemScene
CAS Number: 929616-33-1
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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
C₁₂H₁₆F₃NO₄
Molecular Weight
295.25
Synonyms
4-Pentynoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-2-(trifluoromethyl)-, methyl ester
SMILES
O=C(NC(CC#C)(C(F)(F)F)C(OC)=O)OC(C)(C)C
Tpsa
64.63
Logp
2.0085
H Acceptors
4
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 929616-33-1 | Methyl 2-[(tert-butoxycarbonyl)amino]-2-(trifluoromethyl)pent-4-ynoate | A2B Chem | -- |
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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: C₁₂H₁₆F₃NO₄
Molecular Weight: 295.25
Synonyms: 4-Pentynoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-2-(trifluoromethyl)-, methyl ester
SMILES: O=C(NC(CC#C)(C(F)(F)F)C(OC)=O)OC(C)(C)C
Tpsa: 64.63
Logp: 2.0085
H Acceptors: 4
H Donors: 1
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:
C₁₂H₁₆F₃NO₄
Molecular Weight:
295.25
Synonyms:
4-Pentynoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-2-(trifluoromethyl)-, methyl ester
SMILES:
O=C(NC(CC#C)(C(F)(F)F)C(OC)=O)OC(C)(C)C
Tpsa:
64.63
Logp:
2.0085
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Store at room temperature, keep dry and cool
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₂ClF₂N
Molecular Weight: 171.62
Synonyms: None
SMILES: FC(F)C[C@H]1CCNC1.Cl
Tpsa: 12.03
Logp: 1.6729
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Store at room temperature, keep dry and cool
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₂ClF₂N
Molecular Weight:
171.62
Synonyms:
None
SMILES:
FC(F)C[C@H]1CCNC1.Cl
Tpsa:
12.03
Logp:
1.6729
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: C₇H₃ClF₃N₃
Molecular Weight: 221.57
Synonyms: None
SMILES: FC(F)(C1=NC2=C(N1)C=C(Cl)N=C2)F
Tpsa: 41.57
Logp: 2.6301
H Acceptors: 2
H Donors: 1
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:
C₇H₃ClF₃N₃
Molecular Weight:
221.57
Synonyms:
None
SMILES:
FC(F)(C1=NC2=C(N1)C=C(Cl)N=C2)F
Tpsa:
41.57
Logp:
2.6301
H Acceptors:
2
H Donors:
1
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: C₁₅H₁₄F₃NO₄
Molecular Weight: 329.27
Synonyms: None
SMILES: O=C(NC(CC#C)(C(F)(F)F)C(OC)=O)OCC1=CC=CC=C1
Tpsa: 64.63
Logp: 2.4102
H Acceptors: 4
H Donors: 1
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:
C₁₅H₁₄F₃NO₄
Molecular Weight:
329.27
Synonyms:
None
SMILES:
O=C(NC(CC#C)(C(F)(F)F)C(OC)=O)OCC1=CC=CC=C1
Tpsa:
64.63
Logp:
2.4102
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5