CS-0532858
(3R,4R)-3-Ethyl-4-((1-methyl-1H-imidazol-5-yl)methyl)dihydrofuran-2(3H)-one hydrochloride Pilocarpine Impurity
Manufacturer: ChemScene
CAS Number: 28958-85-2
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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
C₁₁H₁₇ClN₂O₂
Molecular Weight
244.72
Synonyms
Isopilocarpine hydrochloride
SMILES
CC[C@@H](C(OC1)=O)[C@H]1CC2=CN=CN2C.Cl
Tpsa
44.12
Logp
1.5836
H Acceptors
4
H Donors
0
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 28958-85-2 | 2(3H)-Furanone, 3-ethyldihydro-4-[(1-methyl-1H-imidazol-5-yl)methyl]-, monohydrochloride, (3R,4R)- (9CI) | A2B Chem | ₹ 20,962.20 - ₹ 98,907.36 |
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/toxic.svg
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
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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: C₁₁H₁₇ClN₂O₂
Molecular Weight: 244.72
Synonyms: Isopilocarpine hydrochloride
SMILES: CC[C@@H](C(OC1)=O)[C@H]1CC2=CN=CN2C.Cl
Tpsa: 44.12
Logp: 1.5836
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:
C₁₁H₁₇ClN₂O₂
Molecular Weight:
244.72
Synonyms:
Isopilocarpine hydrochloride
SMILES:
CC[C@@H](C(OC1)=O)[C@H]1CC2=CN=CN2C.Cl
Tpsa:
44.12
Logp:
1.5836
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₀N₂O₃
Molecular Weight: 230.22
Synonyms: 4-Nitro-2-phenoxyaniline
SMILES: [O-][N+](C1=CC=C(C(OC2=CC=CC=C2)=C1)N)=O
Tpsa: 78.39
Logp: 2.9693
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₀N₂O₃
Molecular Weight:
230.22
Synonyms:
4-Nitro-2-phenoxyaniline
SMILES:
[O-][N+](C1=CC=C(C(OC2=CC=CC=C2)=C1)N)=O
Tpsa:
78.39
Logp:
2.9693
H Acceptors:
4
H Donors:
1
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: C₂₆H₄₃NaO₉
Molecular Weight: 522.60
Synonyms: Sodium; 9-[(E)-4-[(2R,3S,4aS,7S,8S,8aR)-3,8-dihydroxy-2-[(2S,3S)-3-hydroxybutan-2-yl]-2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyran-7-yl]-3-methylbut-2-enoyl]oxynonanoate
SMILES: O[C@@H]1[C@@]2([H])[C@@](CO[C@H]1C/C(C)=C/C(OCCCCCCCCC(O[Na])=O)=O)([H])C[C@@H]([C@@](O2)([H])[C@@H](C)[C@@H](O)C)O
Tpsa: 131.75
Logp: 2.1346
H Acceptors: 9
H Donors: 3
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₄₃NaO₉
Molecular Weight:
522.60
Synonyms:
Sodium; 9-[(E)-4-[(2R,3S,4aS,7S,8S,8aR)-3,8-dihydroxy-2-[(2S,3S)-3-hydroxybutan-2-yl]-2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyran-7-yl]-3-methylbut-2-enoyl]oxynonanoate
SMILES:
O[C@@H]1[C@@]2([H])[C@@](CO[C@H]1C/C(C)=C/C(OCCCCCCCCC(O[Na])=O)=O)([H])C[C@@H]([C@@](O2)([H])[C@@H](C)[C@@H](O)C)O
Tpsa:
131.75
Logp:
2.1346
H Acceptors:
9
H Donors:
3
Rotatable Bonds:
14
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₀FN₃O
Molecular Weight: 289.35
Synonyms: 4(1H)-Quinolinone, 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)
SMILES: O=C1C=CN(CC)C2=CC(N3CCN(CC3)C)=C(C=C12)F
Tpsa: 28.48
Logp: 1.9123
H Acceptors: 4
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:
C₁₆H₂₀FN₃O
Molecular Weight:
289.35
Synonyms:
4(1H)-Quinolinone, 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)
SMILES:
O=C1C=CN(CC)C2=CC(N3CCN(CC3)C)=C(C=C12)F
Tpsa:
28.48
Logp:
1.9123
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2