CS-1095652
1-(2-(5-(Allylthio)-4-methyl-4H-1,2,4-triazol-3-yl)propan-2-yl)-1H-1,2,4-triazole
Manufacturer: ChemScene
CAS Number: 339026-20-9
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Purity
90%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₁₆N₆S
Molecular Weight
264.35
Synonyms
None
SMILES
N=1N=C(N(C1SCC=C)C)C(N2N=CN=C2)(C)C
Tpsa
61.42
Logp
1.4681
H Acceptors
7
H Donors
0
Rotatable Bonds
5
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: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₆N₆S
Molecular Weight: 264.35
Synonyms: None
SMILES: N=1N=C(N(C1SCC=C)C)C(N2N=CN=C2)(C)C
Tpsa: 61.42
Logp: 1.4681
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 5
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆N₆S
Molecular Weight:
264.35
Synonyms:
None
SMILES:
N=1N=C(N(C1SCC=C)C)C(N2N=CN=C2)(C)C
Tpsa:
61.42
Logp:
1.4681
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
5
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₇N₃O₃
Molecular Weight: 311.34
Synonyms: None
SMILES: O=C(OC)C(=CNC=1C=CC=CC1N)NC(=O)C=2C=CC=CC2
Tpsa: 93.45
Logp: 2.1251
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 5
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₇N₃O₃
Molecular Weight:
311.34
Synonyms:
None
SMILES:
O=C(OC)C(=CNC=1C=CC=CC1N)NC(=O)C=2C=CC=CC2
Tpsa:
93.45
Logp:
2.1251
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
5
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₂F₃NO₃
Molecular Weight: 311.26
Synonyms: None
SMILES: O=C(OC)C1=CC=C(C=C1)CN2C=C(C=CC2=O)C(F)(F)F
Tpsa: 48.3
Logp: 2.702
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₂F₃NO₃
Molecular Weight:
311.26
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C(C=C1)CN2C=C(C=CC2=O)C(F)(F)F
Tpsa:
48.3
Logp:
2.702
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂Cl₂N₂O₂
Molecular Weight: 311.16
Synonyms: None
SMILES: O=C(NC)C=1C=C(Cl)C(=O)N(C1)CC2=CC=C(Cl)C=C2
Tpsa: 51.1
Logp: 2.563
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂Cl₂N₂O₂
Molecular Weight:
311.16
Synonyms:
None
SMILES:
O=C(NC)C=1C=C(Cl)C(=O)N(C1)CC2=CC=C(Cl)C=C2
Tpsa:
51.1
Logp:
2.563
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3