CS-1001629
Nalfurafine Impurity 22
Manufacturer: ChemScene
CAS Number: 152657-10-8
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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
C₂₉H₃₄N₂O₇
Molecular Weight
522.59
Synonyms
None
SMILES
C(O)(=O)C1=C(C(O)=O)C=CC=C1.O[C@]12[C@@]34C=5C(O[C@]3([C@H](NC)CC1)[H])=C(O)C=CC5C[C@]2(N(CC6CC6)CC4)[H]
Tpsa
139.56
Logp
2.6273
H Acceptors
7
H Donors
5
Rotatable Bonds
5
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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: C₂₉H₃₄N₂O₇
Molecular Weight: 522.59
Synonyms: None
SMILES: C(O)(=O)C1=C(C(O)=O)C=CC=C1.O[C@]12[C@@]34C=5C(O[C@]3([C@H](NC)CC1)[H])=C(O)C=CC5C[C@]2(N(CC6CC6)CC4)[H]
Tpsa: 139.56
Logp: 2.6273
H Acceptors: 7
H Donors: 5
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:
C₂₉H₃₄N₂O₇
Molecular Weight:
522.59
Synonyms:
None
SMILES:
C(O)(=O)C1=C(C(O)=O)C=CC=C1.O[C@]12[C@@]34C=5C(O[C@]3([C@H](NC)CC1)[H])=C(O)C=CC5C[C@]2(N(CC6CC6)CC4)[H]
Tpsa:
139.56
Logp:
2.6273
H Acceptors:
7
H Donors:
5
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: C₉H₁₀N₂OS
Molecular Weight: 194.25
Synonyms: None
SMILES: S=C1NC2=CC=C(OC)C=C2N1C
Tpsa: 29.95
Logp: 2.24449
H Acceptors: 3
H Donors: 1
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:
C₉H₁₀N₂OS
Molecular Weight:
194.25
Synonyms:
None
SMILES:
S=C1NC2=CC=C(OC)C=C2N1C
Tpsa:
29.95
Logp:
2.24449
H Acceptors:
3
H Donors:
1
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: C₂₀H₂₆O₃
Molecular Weight: 314.42
Synonyms: None
SMILES: C[C@]12C([C@]3(C[C@@]4([C@@]1(CC[C@@]5(C)[C@]4(CC[C@@H]5O)[H])[H])[H])CO3)=CC(=O)C=C2
Tpsa: 49.83
Logp: 3.0341
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:
C₂₀H₂₆O₃
Molecular Weight:
314.42
Synonyms:
None
SMILES:
C[C@]12C([C@]3(C[C@@]4([C@@]1(CC[C@@]5(C)[C@]4(CC[C@@H]5O)[H])[H])[H])CO3)=CC(=O)C=C2
Tpsa:
49.83
Logp:
3.0341
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: C₉H₁₃NO₃
Molecular Weight: 183.20
Synonyms: None
SMILES: OC1=CC=C(C(O)=C1)C(O)CNC
Tpsa: 72.72
Logp: 0.3506
H Acceptors: 4
H Donors: 4
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:
C₉H₁₃NO₃
Molecular Weight:
183.20
Synonyms:
None
SMILES:
OC1=CC=C(C(O)=C1)C(O)CNC
Tpsa:
72.72
Logp:
0.3506
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
3