CS-1157805
4-Chloro-5-((propylthio)methyl)isoxazol-3(2H)-one
Manufacturer: ChemScene
CAS Number: 89660-93-5
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₇H₁₀ClNO₂S
Molecular Weight
207.67
Synonyms
None
SMILES
O=C1NOC(=C1Cl)CSCCC
Tpsa
46
Logp
2.2645
H Acceptors
3
H Donors
1
Rotatable Bonds
4
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₀ClNO₂S
Molecular Weight: 207.67
Synonyms: None
SMILES: O=C1NOC(=C1Cl)CSCCC
Tpsa: 46
Logp: 2.2645
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₀ClNO₂S
Molecular Weight:
207.67
Synonyms:
None
SMILES:
O=C1NOC(=C1Cl)CSCCC
Tpsa:
46
Logp:
2.2645
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈N₄O
Molecular Weight: 164.17
Synonyms: None
SMILES: N#CC1=C(NC=O)C(=NN1C)C
Tpsa: 70.71
Logp: 0.1685
H Acceptors: 4
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:
C₇H₈N₄O
Molecular Weight:
164.17
Synonyms:
None
SMILES:
N#CC1=C(NC=O)C(=NN1C)C
Tpsa:
70.71
Logp:
0.1685
H Acceptors:
4
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: C₁₂H₁₀N₄O₄
Molecular Weight: 274.24
Synonyms: None
SMILES: O=C(NC)C1=CC=C(C=C1C(=O)C2=NC=CN2)N(=O)=O
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₀N₄O₄
Molecular Weight:
274.24
Synonyms:
None
SMILES:
O=C(NC)C1=CC=C(C=C1C(=O)C2=NC=CN2)N(=O)=O
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: ≥97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉N₃O₄
Molecular Weight: 199.17
Synonyms: None
SMILES: O=C(OC)C1=NN(C(=O)OC)C(N)=C1
Tpsa: 96.44
Logp: -0.1336
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 1
Purity:
≥97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉N₃O₄
Molecular Weight:
199.17
Synonyms:
None
SMILES:
O=C(OC)C1=NN(C(=O)OC)C(N)=C1
Tpsa:
96.44
Logp:
-0.1336
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
1