CS-1038004
4-Isopropyl-5-methyl-4H-1,2,4-triazole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1871744-67-0
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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
C₇H₁₁N₃O₂
Molecular Weight
169.18
Synonyms
None
SMILES
O=C(O)C1=NN=C(N1C(C)C)C
Tpsa
68.01
Logp
0.86562
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: C₇H₁₁N₃O₂
Molecular Weight: 169.18
Synonyms: None
SMILES: O=C(O)C1=NN=C(N1C(C)C)C
Tpsa: 68.01
Logp: 0.86562
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:
C₇H₁₁N₃O₂
Molecular Weight:
169.18
Synonyms:
None
SMILES:
O=C(O)C1=NN=C(N1C(C)C)C
Tpsa:
68.01
Logp:
0.86562
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: C₁₀H₁₆ClN₃
Molecular Weight: 213.71
Synonyms: None
SMILES: ClC1=CN(N=C1N)CC2(C)CCCC2
Tpsa: 43.84
Logp: 2.699
H Acceptors: 3
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:
C₁₀H₁₆ClN₃
Molecular Weight:
213.71
Synonyms:
None
SMILES:
ClC1=CN(N=C1N)CC2(C)CCCC2
Tpsa:
43.84
Logp:
2.699
H Acceptors:
3
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: C₉H₁₀N₂O₂S
Molecular Weight: 210.25
Synonyms: None
SMILES: O=C(O)C=1SC(=NC1)NC(C#C)(C)C
Tpsa: 62.22
Logp: 1.665
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₀N₂O₂S
Molecular Weight:
210.25
Synonyms:
None
SMILES:
O=C(O)C=1SC(=NC1)NC(C#C)(C)C
Tpsa:
62.22
Logp:
1.665
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂ClNO₂S
Molecular Weight: 233.72
Synonyms: None
SMILES: O=S(=O)(NC)C1=C(Cl)C=C(C=C1C)C
Tpsa: 46.17
Logp: 1.86494
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:
C₉H₁₂ClNO₂S
Molecular Weight:
233.72
Synonyms:
None
SMILES:
O=S(=O)(NC)C1=C(Cl)C=C(C=C1C)C
Tpsa:
46.17
Logp:
1.86494
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2