CS-1072246
2-(3-Butyl-5-methyl-4H-1,2,4-triazol-4-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 2749760-93-6
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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
C₉H₁₅N₃O₂
Molecular Weight
197.23
Synonyms
None
SMILES
O=C(O)CN1C(=NN=C1CCCC)C
Tpsa
68.01
Logp
1.01372
H Acceptors
4
H Donors
1
Rotatable Bonds
5
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₅N₃O₂
Molecular Weight: 197.23
Synonyms: None
SMILES: O=C(O)CN1C(=NN=C1CCCC)C
Tpsa: 68.01
Logp: 1.01372
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₅N₃O₂
Molecular Weight:
197.23
Synonyms:
None
SMILES:
O=C(O)CN1C(=NN=C1CCCC)C
Tpsa:
68.01
Logp:
1.01372
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀N₂O₄
Molecular Weight: 198.18
Synonyms: None
SMILES: O=C(OC)COC1=NC=C(OC)C=N1
Tpsa: 70.54
Logp: 0.037
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₀N₂O₄
Molecular Weight:
198.18
Synonyms:
None
SMILES:
O=C(OC)COC1=NC=C(OC)C=N1
Tpsa:
70.54
Logp:
0.037
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉N₃O₃
Molecular Weight: 207.19
Synonyms: None
SMILES: O=C(OC)COC1=NC2=CC=NN2C=C1
Tpsa: 65.72
Logp: 0.2811
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉N₃O₃
Molecular Weight:
207.19
Synonyms:
None
SMILES:
O=C(OC)COC1=NC2=CC=NN2C=C1
Tpsa:
65.72
Logp:
0.2811
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₇N₃O₃
Molecular Weight: 227.26
Synonyms: None
SMILES: O=C(O)C(O)CCN1C=NN=C1CCCC
Tpsa: 88.24
Logp: 0.4563
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₇N₃O₃
Molecular Weight:
227.26
Synonyms:
None
SMILES:
O=C(O)C(O)CCN1C=NN=C1CCCC
Tpsa:
88.24
Logp:
0.4563
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
7