CS-0228678
(5aS,8aS)-tert-Butyl 3-iodo-5a,6,8,8a-tetrahydropyrrolo[3,4-b][1,2,3]triazolo[1,5-d][1,4]oxazine-7(4H)-carboxylate
Manufacturer: ChemScene
CAS Number: 2641076-07-3
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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
C₁₂H₁₇IN₄O₃
Molecular Weight
392.19
Synonyms
None
SMILES
O=C(N1C[C@]2([H])OCC3=C(I)N=NN3[C@@]2([H])C1)OC(C)(C)C
Tpsa
69.48
Logp
1.5733
H Acceptors
6
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: C₁₂H₁₇IN₄O₃
Molecular Weight: 392.19
Synonyms: None
SMILES: O=C(N1C[C@]2([H])OCC3=C(I)N=NN3[C@@]2([H])C1)OC(C)(C)C
Tpsa: 69.48
Logp: 1.5733
H Acceptors: 6
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:
C₁₂H₁₇IN₄O₃
Molecular Weight:
392.19
Synonyms:
None
SMILES:
O=C(N1C[C@]2([H])OCC3=C(I)N=NN3[C@@]2([H])C1)OC(C)(C)C
Tpsa:
69.48
Logp:
1.5733
H Acceptors:
6
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: C₉H₁₀BrClFNO₂
Molecular Weight: 298.54
Synonyms: None
SMILES: O=C(C(C1=CC(Br)=CC=C1F)(C)N)O.Cl
Tpsa: 63.32
Logp: 2.2685
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:
C₉H₁₀BrClFNO₂
Molecular Weight:
298.54
Synonyms:
None
SMILES:
O=C(C(C1=CC(Br)=CC=C1F)(C)N)O.Cl
Tpsa:
63.32
Logp:
2.2685
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: C₁₁H₁₂BrFN₂O
Molecular Weight: 287.13
Synonyms: None
SMILES: NC1=NC(C)(C2=CC(Br)=CC=C2F)COC1
Tpsa: 47.61
Logp: 2.1908
H Acceptors: 3
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:
C₁₁H₁₂BrFN₂O
Molecular Weight:
287.13
Synonyms:
None
SMILES:
NC1=NC(C)(C2=CC(Br)=CC=C2F)COC1
Tpsa:
47.61
Logp:
2.1908
H Acceptors:
3
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: C₅H₁₀O₂
Molecular Weight: 102.13
Synonyms: None
SMILES: OCC1C(OC)C1
Tpsa: 29.46
Logp: 0.0136
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:
C₅H₁₀O₂
Molecular Weight:
102.13
Synonyms:
None
SMILES:
OCC1C(OC)C1
Tpsa:
29.46
Logp:
0.0136
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2