CS-1059546
2-Benzyl-4-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Manufacturer: ChemScene
CAS Number: 860786-43-2
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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
C₁₆H₁₄ClN₃O
Molecular Weight
299.75
Synonyms
None
SMILES
O=C1N(N=C(N1C=2C=CC=C(Cl)C2)C)CC=3C=CC=CC3
Tpsa
39.82
Logp
3.04412
H Acceptors
4
H Donors
0
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: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₄ClN₃O
Molecular Weight: 299.75
Synonyms: None
SMILES: O=C1N(N=C(N1C=2C=CC=C(Cl)C2)C)CC=3C=CC=CC3
Tpsa: 39.82
Logp: 3.04412
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:
C₁₆H₁₄ClN₃O
Molecular Weight:
299.75
Synonyms:
None
SMILES:
O=C1N(N=C(N1C=2C=CC=C(Cl)C2)C)CC=3C=CC=CC3
Tpsa:
39.82
Logp:
3.04412
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: C₁₇H₁₇N₃O₂
Molecular Weight: 295.34
Synonyms: None
SMILES: O=C1N(N=C(N1C=2C=CC=C(OC)C2)C)CC=3C=CC=CC3
Tpsa: 49.05
Logp: 2.39932
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₇N₃O₂
Molecular Weight:
295.34
Synonyms:
None
SMILES:
O=C1N(N=C(N1C=2C=CC=C(OC)C2)C)CC=3C=CC=CC3
Tpsa:
49.05
Logp:
2.39932
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇N₃O₄
Molecular Weight: 291.30
Synonyms: None
SMILES: O=C(OCC)CN1N=C(N(C1=O)C=2C=CC=C(OC)C2)C
Tpsa: 75.35
Logp: 0.91412
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:
C₁₄H₁₇N₃O₄
Molecular Weight:
291.30
Synonyms:
None
SMILES:
O=C(OCC)CN1N=C(N(C1=O)C=2C=CC=C(OC)C2)C
Tpsa:
75.35
Logp:
0.91412
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: C₁₈H₁₈N₆
Molecular Weight: 318.38
Synonyms: None
SMILES: N#CC=1C=NN2C1N=C(C3=C2N(N(CC=4C=CC=CC4)CC3)C)C
Tpsa: 60.46
Logp: 2.3189
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 2
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₈N₆
Molecular Weight:
318.38
Synonyms:
None
SMILES:
N#CC=1C=NN2C1N=C(C3=C2N(N(CC=4C=CC=CC4)CC3)C)C
Tpsa:
60.46
Logp:
2.3189
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
2