CS-0903357
4-(3-Methoxyphenyl)-5-thioxo-1,2,4-triazolidin-3-one
Manufacturer: ChemScene
CAS Number: 1064665-00-4
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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
C₉H₉N₃O₂S
Molecular Weight
223.25
Synonyms
None
SMILES
O=C1NNC(=S)N1C=2C=CC=C(OC)C2
Tpsa
62.81
Logp
1.23179
H Acceptors
4
H Donors
2
Rotatable Bonds
2
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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
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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: C₉H₉N₃O₂S
Molecular Weight: 223.25
Synonyms: None
SMILES: O=C1NNC(=S)N1C=2C=CC=C(OC)C2
Tpsa: 62.81
Logp: 1.23179
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:
C₉H₉N₃O₂S
Molecular Weight:
223.25
Synonyms:
None
SMILES:
O=C1NNC(=S)N1C=2C=CC=C(OC)C2
Tpsa:
62.81
Logp:
1.23179
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: C₈H₅F₂N₃OS
Molecular Weight: 229.21
Synonyms: None
SMILES: O=C1NNC(=S)N1C2=CC=C(F)C(F)=C2
Tpsa: 53.58
Logp: 1.50139
H Acceptors: 3
H Donors: 2
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:
C₈H₅F₂N₃OS
Molecular Weight:
229.21
Synonyms:
None
SMILES:
O=C1NNC(=S)N1C2=CC=C(F)C(F)=C2
Tpsa:
53.58
Logp:
1.50139
H Acceptors:
3
H Donors:
2
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: C₈H₆BrN₃OS
Molecular Weight: 272.12
Synonyms: None
SMILES: O=C1NNC(=S)N1C2=CC=C(Br)C=C2
Tpsa: 53.58
Logp: 1.98569
H Acceptors: 3
H Donors: 2
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:
C₈H₆BrN₃OS
Molecular Weight:
272.12
Synonyms:
None
SMILES:
O=C1NNC(=S)N1C2=CC=C(Br)C=C2
Tpsa:
53.58
Logp:
1.98569
H Acceptors:
3
H Donors:
2
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: C₁₀H₉ClO₃
Molecular Weight: 212.63
Synonyms: None
SMILES: O=C(OC)C1=CC=C(C=C1Cl)C(=O)C
Tpsa: 43.37
Logp: 2.3292
H Acceptors: 3
H Donors: 0
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:
C₁₀H₉ClO₃
Molecular Weight:
212.63
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C(C=C1Cl)C(=O)C
Tpsa:
43.37
Logp:
2.3292
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2