CS-1053288
Ethyl 4-cyclopropyl-3-oxo-2,3-dihydroisothiazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 3033394-23-6
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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
C₉H₁₁NO₃S
Molecular Weight
213.25
Synonyms
None
SMILES
O=C(C(SN1)=C(C2CC2)C1=O)OCC
Tpsa
59.16
Logp
1.4905
H Acceptors
4
H Donors
1
Rotatable Bonds
3
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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: C₉H₁₁NO₃S
Molecular Weight: 213.25
Synonyms: None
SMILES: O=C(C(SN1)=C(C2CC2)C1=O)OCC
Tpsa: 59.16
Logp: 1.4905
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:
C₉H₁₁NO₃S
Molecular Weight:
213.25
Synonyms:
None
SMILES:
O=C(C(SN1)=C(C2CC2)C1=O)OCC
Tpsa:
59.16
Logp:
1.4905
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: C₁₁H₂₂ClNO₂
Molecular Weight: 235.75
Synonyms: None
SMILES: COC([C@H]1C[C@H](CNC1)C(C)(C)C)=O.Cl
Tpsa: 38.33
Logp: 1.853
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:
C₁₁H₂₂ClNO₂
Molecular Weight:
235.75
Synonyms:
None
SMILES:
COC([C@H]1C[C@H](CNC1)C(C)(C)C)=O.Cl
Tpsa:
38.33
Logp:
1.853
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: C₈H₁₄ClNO₄
Molecular Weight: 223.65
Synonyms: None
SMILES: O=C(C1CNCCC1C(O)=O)OC.Cl
Tpsa: 75.63
Logp: -0.1085
H Acceptors: 4
H Donors: 2
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:
C₈H₁₄ClNO₄
Molecular Weight:
223.65
Synonyms:
None
SMILES:
O=C(C1CNCCC1C(O)=O)OC.Cl
Tpsa:
75.63
Logp:
-0.1085
H Acceptors:
4
H Donors:
2
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: C₁₀H₁₀F₃NO₅S₂
Molecular Weight: 345.32
Synonyms: None
SMILES: O=C(C1=C(C2CC2)C(OS(=O)(C(F)(F)F)=O)=NS1)OCC
Tpsa: 82.56
Logp: 2.4256
H Acceptors: 7
H Donors: 0
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:
C₁₀H₁₀F₃NO₅S₂
Molecular Weight:
345.32
Synonyms:
None
SMILES:
O=C(C1=C(C2CC2)C(OS(=O)(C(F)(F)F)=O)=NS1)OCC
Tpsa:
82.56
Logp:
2.4256
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
5