CS-0650039
tert-Butyl 6-(((trifluoromethyl)sulfonyl)oxy)-2-azaspiro[3.3]hept-5-ene-2-carboxylate
Manufacturer: ChemScene
CAS Number: 2455472-44-1
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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
C₁₂H₁₆F₃NO₅S
Molecular Weight
343.32
Synonyms
None
SMILES
O=C(N1CC2(C=C(OS(=O)(C(F)(F)F)=O)C2)C1)OC(C)(C)C
Tpsa
72.91
Logp
2.3773
H Acceptors
5
H Donors
0
Rotatable Bonds
2
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: C₁₂H₁₆F₃NO₅S
Molecular Weight: 343.32
Synonyms: None
SMILES: O=C(N1CC2(C=C(OS(=O)(C(F)(F)F)=O)C2)C1)OC(C)(C)C
Tpsa: 72.91
Logp: 2.3773
H Acceptors: 5
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:
C₁₂H₁₆F₃NO₅S
Molecular Weight:
343.32
Synonyms:
None
SMILES:
O=C(N1CC2(C=C(OS(=O)(C(F)(F)F)=O)C2)C1)OC(C)(C)C
Tpsa:
72.91
Logp:
2.3773
H Acceptors:
5
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: C₉H₁₀N₂O
Molecular Weight: 162.19
Synonyms: None
SMILES: OC[C@H](N)C1=NC=C(C#C)C=C1
Tpsa: 59.14
Logp: 0.055
H Acceptors: 3
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:
C₉H₁₀N₂O
Molecular Weight:
162.19
Synonyms:
None
SMILES:
OC[C@H](N)C1=NC=C(C#C)C=C1
Tpsa:
59.14
Logp:
0.055
H Acceptors:
3
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: C₉H₈ClN
Molecular Weight: 165.62
Synonyms: None
SMILES: NCC1=CC=C(C#C)C(Cl)=C1
Tpsa: 26.02
Logp: 1.78
H Acceptors: 1
H Donors: 1
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:
C₉H₈ClN
Molecular Weight:
165.62
Synonyms:
None
SMILES:
NCC1=CC=C(C#C)C(Cl)=C1
Tpsa:
26.02
Logp:
1.78
H Acceptors:
1
H Donors:
1
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: C₁₂H₁₄BrF₂NO₂
Molecular Weight: 322.15
Synonyms: None
SMILES: O=C(OC(C)(C)C)NCC1=CC(F)=C(Br)C(F)=C1
Tpsa: 38.33
Logp: 3.752
H Acceptors: 2
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:
C₁₂H₁₄BrF₂NO₂
Molecular Weight:
322.15
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NCC1=CC(F)=C(Br)C(F)=C1
Tpsa:
38.33
Logp:
3.752
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2