CS-0561531
2-Methyl-2-(1-methyl-1H-pyrazole-4-carboxamido)propanoic acid
Manufacturer: ChemScene
CAS Number: 1247232-29-6
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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
C₉H₁₃N₃O₃
Molecular Weight
211.22
Synonyms
None
SMILES
O=C(O)C(NC(=O)C=1C=NN(C1)C)(C)C
Tpsa
84.22
Logp
0.0131
H Acceptors
4
H Donors
2
Rotatable Bonds
3
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: C₉H₁₃N₃O₃
Molecular Weight: 211.22
Synonyms: None
SMILES: O=C(O)C(NC(=O)C=1C=NN(C1)C)(C)C
Tpsa: 84.22
Logp: 0.0131
H Acceptors: 4
H Donors: 2
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:
C₉H₁₃N₃O₃
Molecular Weight:
211.22
Synonyms:
None
SMILES:
O=C(O)C(NC(=O)C=1C=NN(C1)C)(C)C
Tpsa:
84.22
Logp:
0.0131
H Acceptors:
4
H Donors:
2
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: C₁₀H₉F₂N₃O
Molecular Weight: 225.19
Synonyms: {1-[(2,4-difluorophenyl)methyl]-1h-1,2,3-triazol-4-yl}methanol
SMILES: C1=CC(=C(C=C1F)F)CN2C=C(N=N2)CO
Tpsa: 50.94
Logp: 1.0969
H Acceptors: 4
H Donors: 1
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:
C₁₀H₉F₂N₃O
Molecular Weight:
225.19
Synonyms:
{1-[(2,4-difluorophenyl)methyl]-1h-1,2,3-triazol-4-yl}methanol
SMILES:
C1=CC(=C(C=C1F)F)CN2C=C(N=N2)CO
Tpsa:
50.94
Logp:
1.0969
H Acceptors:
4
H Donors:
1
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: C₉H₁₁N₃S
Molecular Weight: 193.27
Synonyms: None
SMILES: C1=CN(N=C1)C(CN)C2=CSC=C2
Tpsa: 43.84
Logp: 1.4927
H Acceptors: 4
H Donors: 1
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:
C₉H₁₁N₃S
Molecular Weight:
193.27
Synonyms:
None
SMILES:
C1=CN(N=C1)C(CN)C2=CSC=C2
Tpsa:
43.84
Logp:
1.4927
H Acceptors:
4
H Donors:
1
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: C₁₁H₁₂BrNO
Molecular Weight: 254.12
Synonyms: None
SMILES: C1CC(C1)NC(=O)C2=CC=C(C=C2)Br
Tpsa: 29.1
Logp: 2.7314
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂BrNO
Molecular Weight:
254.12
Synonyms:
None
SMILES:
C1CC(C1)NC(=O)C2=CC=C(C=C2)Br
Tpsa:
29.1
Logp:
2.7314
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2