CS-0371822
Nelonicline diastereomer
Manufacturer: ChemScene
CAS Number: None
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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
C₁₇H₁₉N₃OS
Molecular Weight
313.42
Synonyms
ABT-126 (diastereomer)
SMILES
C1(C2=NN=C(O[C@H]3[C@@H]4C[C@@H]5C[C@H]3C[N@](C4)C5)S2)=CC=CC=C1
Tpsa
38.25
Logp
2.9241
H Acceptors
5
H Donors
0
Rotatable Bonds
3
Other Options
...
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: C₁₇H₁₉N₃OS
Molecular Weight: 313.42
Synonyms: ABT-126 (diastereomer)
SMILES: C1(C2=NN=C(O[C@H]3[C@@H]4C[C@@H]5C[C@H]3C[N@](C4)C5)S2)=CC=CC=C1
Tpsa: 38.25
Logp: 2.9241
H Acceptors: 5
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:
C₁₇H₁₉N₃OS
Molecular Weight:
313.42
Synonyms:
ABT-126 (diastereomer)
SMILES:
C1(C2=NN=C(O[C@H]3[C@@H]4C[C@@H]5C[C@H]3C[N@](C4)C5)S2)=CC=CC=C1
Tpsa:
38.25
Logp:
2.9241
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇BrF₂O
Molecular Weight: 249.05
Synonyms: None
SMILES: FC1(C2=CC=C(C=C2OCC1)Br)F
Tpsa: 9.23
Logp: 3.3234
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇BrF₂O
Molecular Weight:
249.05
Synonyms:
None
SMILES:
FC1(C2=CC=C(C=C2OCC1)Br)F
Tpsa:
9.23
Logp:
3.3234
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 97%
MDL No: None
Storage: RT, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈O₄
Molecular Weight: 180.16
Synonyms: 2-hydroxy-5-methoxyisophthaldehyde
SMILES: O=CC1=CC(OC)=CC(C=O)=C1O
Tpsa: 63.6
Logp: 1.0258
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
RT, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈O₄
Molecular Weight:
180.16
Synonyms:
2-hydroxy-5-methoxyisophthaldehyde
SMILES:
O=CC1=CC(OC)=CC(C=O)=C1O
Tpsa:
63.6
Logp:
1.0258
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₄N₂O₈
Molecular Weight: 256.13
Synonyms: 2,6-dinitrobenzene-1,4-dicarboxylic acid
SMILES: O=C(C1=CC([N+]([O-])=O)=C(C(O)=O)C([N+]([O-])=O)=C1)O
Tpsa: 160.88
Logp: 0.8994
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄N₂O₈
Molecular Weight:
256.13
Synonyms:
2,6-dinitrobenzene-1,4-dicarboxylic acid
SMILES:
O=C(C1=CC([N+]([O-])=O)=C(C(O)=O)C([N+]([O-])=O)=C1)O
Tpsa:
160.88
Logp:
0.8994
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
4