CS-1078635
(S)-3-Methyl-2-(1-methyl-1H-pyrazol-4-yl)butanoic acid
Manufacturer: ChemScene
CAS Number: 2906077-06-1
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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
C₉H₁₄N₂O₂
Molecular Weight
182.22
Synonyms
None
SMILES
[C@@H](C(C)C)(C(O)=O)C1=CN(C)N=C1
Tpsa
55.12
Logp
1.2443
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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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: C₉H₁₄N₂O₂
Molecular Weight: 182.22
Synonyms: None
SMILES: [C@@H](C(C)C)(C(O)=O)C1=CN(C)N=C1
Tpsa: 55.12
Logp: 1.2443
H Acceptors: 3
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:
C₉H₁₄N₂O₂
Molecular Weight:
182.22
Synonyms:
None
SMILES:
[C@@H](C(C)C)(C(O)=O)C1=CN(C)N=C1
Tpsa:
55.12
Logp:
1.2443
H Acceptors:
3
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: C₉H₅F₃N₂O₂
Molecular Weight: 230.14
Synonyms: None
SMILES: O=C(O)C=1C=C(F)C2=NC(=CN2C1)C(F)F
Tpsa: 54.6
Logp: 2.1092
H Acceptors: 3
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:
C₉H₅F₃N₂O₂
Molecular Weight:
230.14
Synonyms:
None
SMILES:
O=C(O)C=1C=C(F)C2=NC(=CN2C1)C(F)F
Tpsa:
54.6
Logp:
2.1092
H Acceptors:
3
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: C₁₂H₁₂N₄O₂
Molecular Weight: 244.25
Synonyms: None
SMILES: N#CC=1C=CC2=C(N=NN2C(=O)OC(C)(C)C)C1
Tpsa: 80.8
Logp: 2.08618
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂N₄O₂
Molecular Weight:
244.25
Synonyms:
None
SMILES:
N#CC=1C=CC2=C(N=NN2C(=O)OC(C)(C)C)C1
Tpsa:
80.8
Logp:
2.08618
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆Cl₂FN₃O₂
Molecular Weight: 278.07
Synonyms: None
SMILES: O=C1N=C(Cl)NC=2C(F)=C(Cl)N=C(OCC)C12
Tpsa: 67.87
Logp: 2.1627
H Acceptors: 4
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:
C₉H₆Cl₂FN₃O₂
Molecular Weight:
278.07
Synonyms:
None
SMILES:
O=C1N=C(Cl)NC=2C(F)=C(Cl)N=C(OCC)C12
Tpsa:
67.87
Logp:
2.1627
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2