CS-0134344
(2R,4S)-1-(tert-Butylsulfonyl)-2-(2,5-difluorophenyl)-4-fluoropyrrolidine
Manufacturer: ChemScene
CAS Number: 1887746-45-3
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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
C₁₄H₁₈F₃NO₂S
Molecular Weight
321.36
Synonyms
None
SMILES
F[C@H]1C[C@H](C2=CC(F)=CC=C2F)N(S(=O)(C(C)(C)C)=O)C1
Tpsa
37.38
Logp
3.178
H Acceptors
2
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1887746-45-3 | (2R,4S)-1-(tert-Butylsulfonyl)-2-(2,5-difluorophenyl)-4-fluoropyrrolidine | A2B Chem | -- |
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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: C₁₄H₁₈F₃NO₂S
Molecular Weight: 321.36
Synonyms: None
SMILES: F[C@H]1C[C@H](C2=CC(F)=CC=C2F)N(S(=O)(C(C)(C)C)=O)C1
Tpsa: 37.38
Logp: 3.178
H Acceptors: 2
H Donors: 0
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:
C₁₄H₁₈F₃NO₂S
Molecular Weight:
321.36
Synonyms:
None
SMILES:
F[C@H]1C[C@H](C2=CC(F)=CC=C2F)N(S(=O)(C(C)(C)C)=O)C1
Tpsa:
37.38
Logp:
3.178
H Acceptors:
2
H Donors:
0
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: C₂₅H₃₂N₂O₄
Molecular Weight: 424.53
Synonyms: (2R,3R,4R)-ADL 8-2698; (2R,3R,4R)-LY 246736; Alvimopan Impurity 8
SMILES: O=C(O)CNC([C@@H](CN1C[C@H](C)[C@](C)(C2=CC=CC(O)=C2)CC1)CC3=CC=CC=C3)=O
Tpsa: 89.87
Logp: 3.0514
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₂N₂O₄
Molecular Weight:
424.53
Synonyms:
(2R,3R,4R)-ADL 8-2698; (2R,3R,4R)-LY 246736; Alvimopan Impurity 8
SMILES:
O=C(O)CNC([C@@H](CN1C[C@H](C)[C@](C)(C2=CC=CC(O)=C2)CC1)CC3=CC=CC=C3)=O
Tpsa:
89.87
Logp:
3.0514
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
8
Purity: 98%
MDL No: MFCD28977540
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂N₄O
Molecular Weight: 240.26
Synonyms: CB63303373
SMILES: NC1=CC=C(OC2=CC3=NC=NN3C=C2)C(C)=C1
Tpsa: 65.44
Logp: 2.41222
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28977540
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂N₄O
Molecular Weight:
240.26
Synonyms:
CB63303373
SMILES:
NC1=CC=C(OC2=CC3=NC=NN3C=C2)C(C)=C1
Tpsa:
65.44
Logp:
2.41222
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD08898850
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₆N₂O₃
Molecular Weight: 282.38
Synonyms: 1-Piperidinecarboxylic acid, 4-[(2E)-3-(dimethylamino)-1-oxo-2-propen-1-yl]-, 1,1-dimethylethyl ester
SMILES: O=C(N1CCC(C(/C=C/N(C)C)=O)CC1)OC(C)(C)C
Tpsa: 49.85
Logp: 2.914
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD08898850
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₆N₂O₃
Molecular Weight:
282.38
Synonyms:
1-Piperidinecarboxylic acid, 4-[(2E)-3-(dimethylamino)-1-oxo-2-propen-1-yl]-, 1,1-dimethylethyl ester
SMILES:
O=C(N1CCC(C(/C=C/N(C)C)=O)CC1)OC(C)(C)C
Tpsa:
49.85
Logp:
2.914
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3