CS-0214501
(R)-5-Chloro-8-methoxy-3-methylisochroman-1-one
Manufacturer: ChemScene
CAS Number: 1421840-10-9
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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
C₁₁H₁₁ClO₃
Molecular Weight
226.66
Synonyms
None
SMILES
O=C1C2=C(OC)C=CC(Cl)=C2C[C@@H](C)O1
Tpsa
35.53
Logp
2.45
H Acceptors
3
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1421840-10-9 | (R)-5-Chloro-8-methoxy-3-methylisochroman-1-one | 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: C₁₁H₁₁ClO₃
Molecular Weight: 226.66
Synonyms: None
SMILES: O=C1C2=C(OC)C=CC(Cl)=C2C[C@@H](C)O1
Tpsa: 35.53
Logp: 2.45
H Acceptors: 3
H Donors: 0
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:
C₁₁H₁₁ClO₃
Molecular Weight:
226.66
Synonyms:
None
SMILES:
O=C1C2=C(OC)C=CC(Cl)=C2C[C@@H](C)O1
Tpsa:
35.53
Logp:
2.45
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 95+%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₃₁N₃O₁₃
Molecular Weight: 545.49
Synonyms: None
SMILES: CC(N[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1OC2=CC=C(C=C2)[N+]([O-])=O)CO)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(C)=O)=O
Tpsa: 239.41
Logp: -3.1147
H Acceptors: 13
H Donors: 7
Rotatable Bonds: 9
Purity:
95+%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₃₁N₃O₁₃
Molecular Weight:
545.49
Synonyms:
None
SMILES:
CC(N[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1OC2=CC=C(C=C2)[N+]([O-])=O)CO)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(C)=O)=O
Tpsa:
239.41
Logp:
-3.1147
H Acceptors:
13
H Donors:
7
Rotatable Bonds:
9
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₃H₇₂N₂O₃₃
Molecular Weight: 1145.03
Synonyms: None
SMILES: OC([C@@]1(O[C@@]([C@@H]([C@H](C1)O)NC(C)=O)([H])[C@H](O)[C@H](O)CO)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@@H]2O)CO)O[C@H]3[C@@H]([C@H]([C@@H](O[C@@H]3CO)O[C@@H]4[C@H]([C@@H](O[C@@H]([C@@H]4O)CO)O[C@H]([C@H](O)CO)[C@H](O)[C@@H](O)C=O)O)NC(C)=O)O[C@H]5[C@H]([C@@H]([C@@H]([C@@H](O5)C)O)O)O)O)=O
Tpsa: 569.01
Logp: -13.7368
H Acceptors: 32
H Donors: 21
Rotatable Bonds: 24
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₃H₇₂N₂O₃₃
Molecular Weight:
1145.03
Synonyms:
None
SMILES:
OC([C@@]1(O[C@@]([C@@H]([C@H](C1)O)NC(C)=O)([H])[C@H](O)[C@H](O)CO)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@@H]2O)CO)O[C@H]3[C@@H]([C@H]([C@@H](O[C@@H]3CO)O[C@@H]4[C@H]([C@@H](O[C@@H]([C@@H]4O)CO)O[C@H]([C@H](O)CO)[C@H](O)[C@@H](O)C=O)O)NC(C)=O)O[C@H]5[C@H]([C@@H]([C@@H]([C@@H](O5)C)O)O)O)O)=O
Tpsa:
569.01
Logp:
-13.7368
H Acceptors:
32
H Donors:
21
Rotatable Bonds:
24
Purity: 98%
MDL No: MFCD00154760
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₇ClN₂O₂
Molecular Weight: 174.58
Synonyms: 5-Chloro-1,3-dimethyluracil
SMILES: O=C1N(C)C(C(Cl)=CN1C)=O
Tpsa: 44
Logp: -0.2626
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD00154760
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₇ClN₂O₂
Molecular Weight:
174.58
Synonyms:
5-Chloro-1,3-dimethyluracil
SMILES:
O=C1N(C)C(C(Cl)=CN1C)=O
Tpsa:
44
Logp:
-0.2626
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
0