CS-1042635
2-(4,5-Dimethyl-4H-1,2,4-triazol-3-yl)-2-methylpropanoic acid
Manufacturer: ChemScene
CAS Number: 1935623-28-1
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₈H₁₃N₃O₂
Molecular Weight
183.21
Synonyms
None
SMILES
O=C(O)C(C1=NN=C(N1C)C)(C)C
Tpsa
68.01
Logp
0.48572
H Acceptors
4
H Donors
1
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
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₃N₃O₂
Molecular Weight: 183.21
Synonyms: None
SMILES: O=C(O)C(C1=NN=C(N1C)C)(C)C
Tpsa: 68.01
Logp: 0.48572
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₃N₃O₂
Molecular Weight:
183.21
Synonyms:
None
SMILES:
O=C(O)C(C1=NN=C(N1C)C)(C)C
Tpsa:
68.01
Logp:
0.48572
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆IN₃
Molecular Weight: 271.06
Synonyms: None
SMILES: IC1=CC=C2N=C(N=CC2=C1)N
Tpsa: 51.8
Logp: 1.8166
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆IN₃
Molecular Weight:
271.06
Synonyms:
None
SMILES:
IC1=CC=C2N=C(N=CC2=C1)N
Tpsa:
51.8
Logp:
1.8166
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆BrClF₃N
Molecular Weight: 288.49
Synonyms: None
SMILES: FC(F)(F)CNC=1C=C(Cl)C=C(Br)C1
Tpsa: 12.03
Logp: 4.0767
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆BrClF₃N
Molecular Weight:
288.49
Synonyms:
None
SMILES:
FC(F)(F)CNC=1C=C(Cl)C=C(Br)C1
Tpsa:
12.03
Logp:
4.0767
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₁FN₂
Molecular Weight: 154.18
Synonyms: None
SMILES: FC1=CN=C(C(N)=C1)CCC
Tpsa: 38.91
Logp: 1.7554
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₁FN₂
Molecular Weight:
154.18
Synonyms:
None
SMILES:
FC1=CN=C(C(N)=C1)CCC
Tpsa:
38.91
Logp:
1.7554
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2