CS-0620425
(S)-3-(Trifluoromethyl)-7,7a,8,9,10,11-hexahydro-6H-pyrazino[1,2-d]pyrido[3,2-b][1,4]oxazepine
Manufacturer: ChemScene
CAS Number: 2817668-75-8
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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
C₁₂H₁₄F₃N₃O
Molecular Weight
273.25
Synonyms
None
SMILES
FC(C1=CN=C2C(OCC[C@]3([H])N2CCNC3)=C1)(F)F
Tpsa
37.39
Logp
1.6611
H Acceptors
4
H Donors
1
Rotatable Bonds
0
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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: C₁₂H₁₄F₃N₃O
Molecular Weight: 273.25
Synonyms: None
SMILES: FC(C1=CN=C2C(OCC[C@]3([H])N2CCNC3)=C1)(F)F
Tpsa: 37.39
Logp: 1.6611
H Acceptors: 4
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:
C₁₂H₁₄F₃N₃O
Molecular Weight:
273.25
Synonyms:
None
SMILES:
FC(C1=CN=C2C(OCC[C@]3([H])N2CCNC3)=C1)(F)F
Tpsa:
37.39
Logp:
1.6611
H Acceptors:
4
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: C₁₂H₁₃F₃N₄O
Molecular Weight: 286.25
Synonyms: None
SMILES: O=C1[C@@](CNCC2)([H])N2C3=NC=C(C(F)(F)F)C=C3N1C
Tpsa: 48.47
Logp: 0.855
H Acceptors: 4
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:
C₁₂H₁₃F₃N₄O
Molecular Weight:
286.25
Synonyms:
None
SMILES:
O=C1[C@@](CNCC2)([H])N2C3=NC=C(C(F)(F)F)C=C3N1C
Tpsa:
48.47
Logp:
0.855
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₁BrO₂
Molecular Weight: 195.05
Synonyms: None
SMILES: CC1(C)OC[C@H](CBr)O1
Tpsa: 18.46
Logp: 1.5328
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₁BrO₂
Molecular Weight:
195.05
Synonyms:
None
SMILES:
CC1(C)OC[C@H](CBr)O1
Tpsa:
18.46
Logp:
1.5328
H Acceptors:
2
H Donors:
0
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: C₆H₁₀S₂
Molecular Weight: 146.27
Synonyms: None
SMILES: C1(SSC2CC2)CC1
Tpsa: 0
Logp: 2.6926
H Acceptors: 2
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:
C₆H₁₀S₂
Molecular Weight:
146.27
Synonyms:
None
SMILES:
C1(SSC2CC2)CC1
Tpsa:
0
Logp:
2.6926
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3