CS-1085720
(4aS,5aS)-2-amino-4,4a,5,5a-tetrahydrocyclopropa[4,5]cyclopenta[1,2-b]thiophene-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 2940876-14-0
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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
C₉H₈N₂S
Molecular Weight
176.24
Synonyms
None
SMILES
C(#N)C=1C2=C([C@@]3([C@@](C3)(C2)[H])[H])SC1N
Tpsa
49.81
Logp
1.86158
H Acceptors
3
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: C₉H₈N₂S
Molecular Weight: 176.24
Synonyms: None
SMILES: C(#N)C=1C2=C([C@@]3([C@@](C3)(C2)[H])[H])SC1N
Tpsa: 49.81
Logp: 1.86158
H Acceptors: 3
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:
C₉H₈N₂S
Molecular Weight:
176.24
Synonyms:
None
SMILES:
C(#N)C=1C2=C([C@@]3([C@@](C3)(C2)[H])[H])SC1N
Tpsa:
49.81
Logp:
1.86158
H Acceptors:
3
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: C₁₂H₂₀FNO₅
Molecular Weight: 277.29
Synonyms: None
SMILES: C(OC(C)(C)C)(=O)N1[C@H](C(OC)=O)C[C@](CO)(F)C1
Tpsa: 76.07
Logp: 0.8694
H Acceptors: 5
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:
C₁₂H₂₀FNO₅
Molecular Weight:
277.29
Synonyms:
None
SMILES:
C(OC(C)(C)C)(=O)N1[C@H](C(OC)=O)C[C@](CO)(F)C1
Tpsa:
76.07
Logp:
0.8694
H Acceptors:
5
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: C₁₃H₂₃FN₂O₄
Molecular Weight: 290.33
Synonyms: None
SMILES: C(OC)(=O)[C@@H]1N(C(OC(C)(C)C)=O)CC[C@@](CN)(F)C1
Tpsa: 81.86
Logp: 1.2259
H Acceptors: 5
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:
C₁₃H₂₃FN₂O₄
Molecular Weight:
290.33
Synonyms:
None
SMILES:
C(OC)(=O)[C@@H]1N(C(OC(C)(C)C)=O)CC[C@@](CN)(F)C1
Tpsa:
81.86
Logp:
1.2259
H Acceptors:
5
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: C₇H₉BrFN
Molecular Weight: 206.06
Synonyms: None
SMILES: C(Br)[C@@]1(F)C[C@H](C#N)CC1
Tpsa: 23.79
Logp: 2.41328
H Acceptors: 1
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:
C₇H₉BrFN
Molecular Weight:
206.06
Synonyms:
None
SMILES:
C(Br)[C@@]1(F)C[C@H](C#N)CC1
Tpsa:
23.79
Logp:
2.41328
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1