CS-0907371
(R)-5-Ethyl-5-hydroxy-4,5-dihydrooxepino[3,4-c]pyridine-3,9(1H,8H)-dione
Manufacturer: ChemScene
CAS Number: 221054-70-2
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₁₃NO₄
Molecular Weight
223.23
Synonyms
None
SMILES
CC[C@@]1(C2=C(COC(C1)=O)C(NC=C2)=O)O
Tpsa
79.39
Logp
0.4194
H Acceptors
4
H Donors
2
Rotatable Bonds
1
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃NO₄
Molecular Weight: 223.23
Synonyms: None
SMILES: CC[C@@]1(C2=C(COC(C1)=O)C(NC=C2)=O)O
Tpsa: 79.39
Logp: 0.4194
H Acceptors: 4
H Donors: 2
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:
C₁₁H₁₃NO₄
Molecular Weight:
223.23
Synonyms:
None
SMILES:
CC[C@@]1(C2=C(COC(C1)=O)C(NC=C2)=O)O
Tpsa:
79.39
Logp:
0.4194
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Store at room temperature, keep dry and cool
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇Cl₃N₂O₂
Molecular Weight: 351.66
Synonyms: None
SMILES: O=C1OC2(CCNCC2)CN1CC3=CC=C(C(Cl)=C3)Cl.Cl
Tpsa: 41.57
Logp: 3.4896
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Store at room temperature, keep dry and cool
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇Cl₃N₂O₂
Molecular Weight:
351.66
Synonyms:
None
SMILES:
O=C1OC2(CCNCC2)CN1CC3=CC=C(C(Cl)=C3)Cl.Cl
Tpsa:
41.57
Logp:
3.4896
H Acceptors:
3
H Donors:
1
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: C₆H₁₃O₈P
Molecular Weight: 244.14
Synonyms: None
SMILES: O[C@@H]1C(OP(O)(O)=O)O[C@@H](C)[C@@H](O)[C@H]1O
Tpsa: 136.68
Logp: -2.0768
H Acceptors: 6
H Donors: 5
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:
C₆H₁₃O₈P
Molecular Weight:
244.14
Synonyms:
None
SMILES:
O[C@@H]1C(OP(O)(O)=O)O[C@@H](C)[C@@H](O)[C@H]1O
Tpsa:
136.68
Logp:
-2.0768
H Acceptors:
6
H Donors:
5
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: C₆H₁₆NO₉P
Molecular Weight: 277.17
Synonyms: None
SMILES: O=P(O)(O)O[C@H]1O[C@@H]([C@@H]([C@@H]([C@H]1N)O)O)CO.O
Tpsa: 194.2
Logp: -3.9627
H Acceptors: 7
H Donors: 6
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:
C₆H₁₆NO₉P
Molecular Weight:
277.17
Synonyms:
None
SMILES:
O=P(O)(O)O[C@H]1O[C@@H]([C@@H]([C@@H]([C@H]1N)O)O)CO.O
Tpsa:
194.2
Logp:
-3.9627
H Acceptors:
7
H Donors:
6
Rotatable Bonds:
3