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

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H315-H319-H335

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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ChemScene

CS-0228678

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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

Img

ChemScene

CS-0228679

--


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

Img

ChemScene

CS-0228680

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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:
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

Img

ChemScene

CS-0228681

--


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