CS-0728098
3-((4-Methyl-4H-1,2,4-triazol-3-yl)thio)propanoic acid
Manufacturer: ChemScene
CAS Number: 723742-57-2
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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
C₆H₉N₃O₂S
Molecular Weight
187.22
Synonyms
None
SMILES
CN1C=NN=C1SCCC(O)=O
Tpsa
68.01
Logp
0.3819
H Acceptors
5
H Donors
1
Rotatable Bonds
4
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₆H₉N₃O₂S
Molecular Weight: 187.22
Synonyms: None
SMILES: CN1C=NN=C1SCCC(O)=O
Tpsa: 68.01
Logp: 0.3819
H Acceptors: 5
H Donors: 1
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:
C₆H₉N₃O₂S
Molecular Weight:
187.22
Synonyms:
None
SMILES:
CN1C=NN=C1SCCC(O)=O
Tpsa:
68.01
Logp:
0.3819
H Acceptors:
5
H Donors:
1
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: C₁₁H₁₈N₂O₄
Molecular Weight: 242.27
Synonyms: None
SMILES: CC1(C)N(CCNC1=O)C(=O)CCCC(O)=O
Tpsa: 86.71
Logp: -0.0217
H Acceptors: 3
H Donors: 2
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:
C₁₁H₁₈N₂O₄
Molecular Weight:
242.27
Synonyms:
None
SMILES:
CC1(C)N(CCNC1=O)C(=O)CCCC(O)=O
Tpsa:
86.71
Logp:
-0.0217
H Acceptors:
3
H Donors:
2
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: C₁₅H₁₄O₄
Molecular Weight: 258.27
Synonyms: None
SMILES: COC1=CC=C(C=C1)C1=C(C=C(OC)C=C1)C(O)=O
Tpsa: 55.76
Logp: 3.069
H Acceptors: 3
H Donors: 1
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:
C₁₅H₁₄O₄
Molecular Weight:
258.27
Synonyms:
None
SMILES:
COC1=CC=C(C=C1)C1=C(C=C(OC)C=C1)C(O)=O
Tpsa:
55.76
Logp:
3.069
H Acceptors:
3
H Donors:
1
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: C₁₁H₁₇NO₃
Molecular Weight: 211.26
Synonyms: None
SMILES: CC(C)CC1=C(CN)C(C(O)=O)=C(C)O1
Tpsa: 76.46
Logp: 1.94342
H Acceptors: 3
H Donors: 2
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:
C₁₁H₁₇NO₃
Molecular Weight:
211.26
Synonyms:
None
SMILES:
CC(C)CC1=C(CN)C(C(O)=O)=C(C)O1
Tpsa:
76.46
Logp:
1.94342
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4