CS-0913950
4-(((2R,3S)-2-(2,4-difluorophenyl)-3-methyloxiran-2-yl)methyl)-4H-1,2,4-triazole
Manufacturer: ChemScene
CAS Number: 2122222-15-3
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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
C₁₂H₁₁F₂N₃O
Molecular Weight
251.23
Synonyms
None
SMILES
C([C@@]1([C@H](C)O1)C2=C(F)C=C(F)C=C2)N3C=NN=C3
Tpsa
43.24
Logp
1.8705
H Acceptors
4
H Donors
0
Rotatable Bonds
3
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₂H₁₁F₂N₃O
Molecular Weight: 251.23
Synonyms: None
SMILES: C([C@@]1([C@H](C)O1)C2=C(F)C=C(F)C=C2)N3C=NN=C3
Tpsa: 43.24
Logp: 1.8705
H Acceptors: 4
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:
C₁₂H₁₁F₂N₃O
Molecular Weight:
251.23
Synonyms:
None
SMILES:
C([C@@]1([C@H](C)O1)C2=C(F)C=C(F)C=C2)N3C=NN=C3
Tpsa:
43.24
Logp:
1.8705
H Acceptors:
4
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: C₁₈H₂₂F₂N₄O
Molecular Weight: 348.39
Synonyms: None
SMILES: [C@@]([C@@H](C)N1CCC(C)=CC1)(CN2C=NC=N2)(O)C3=C(F)C=C(F)C=C3
Tpsa: 54.18
Logp: 2.4846
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₂F₂N₄O
Molecular Weight:
348.39
Synonyms:
None
SMILES:
[C@@]([C@@H](C)N1CCC(C)=CC1)(CN2C=NC=N2)(O)C3=C(F)C=C(F)C=C3
Tpsa:
54.18
Logp:
2.4846
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₁N₅O₃
Molecular Weight: 367.40
Synonyms: None
SMILES: N#CC=1C=CC=CC1CN2C(=O)N(C(=O)C=C2N3CCCC(NC=O)C3)C
Tpsa: 100.13
Logp: 0.18178
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₁N₅O₃
Molecular Weight:
367.40
Synonyms:
None
SMILES:
N#CC=1C=CC=CC1CN2C(=O)N(C(=O)C=C2N3CCCC(NC=O)C3)C
Tpsa:
100.13
Logp:
0.18178
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₇N₃
Molecular Weight: 215.29
Synonyms: None
SMILES: C(C1=C(C#N)C=CC=C1)N2C[C@H](N)CCC2
Tpsa: 53.05
Logp: 1.48138
H Acceptors: 3
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:
C₁₃H₁₇N₃
Molecular Weight:
215.29
Synonyms:
None
SMILES:
C(C1=C(C#N)C=CC=C1)N2C[C@H](N)CCC2
Tpsa:
53.05
Logp:
1.48138
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2