CS-0542216
2-(6-Cyanopyridin-3-yl)propanoic acid
Manufacturer: ChemScene
CAS Number: 1419602-73-5
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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
C₉H₈N₂O₂
Molecular Weight
176.17
Synonyms
None
SMILES
N#CC1=NC=C(C(C)C(O)=O)C=C1
Tpsa
73.98
Logp
1.14138
H Acceptors
3
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
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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: C₉H₈N₂O₂
Molecular Weight: 176.17
Synonyms: None
SMILES: N#CC1=NC=C(C(C)C(O)=O)C=C1
Tpsa: 73.98
Logp: 1.14138
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:
C₉H₈N₂O₂
Molecular Weight:
176.17
Synonyms:
None
SMILES:
N#CC1=NC=C(C(C)C(O)=O)C=C1
Tpsa:
73.98
Logp:
1.14138
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: C₉H₁₃ClFNO₄
Molecular Weight: 253.66
Synonyms: None
SMILES: O=C(N1[C@](C(OC)=O)(F)[C@@H](Cl)CC1)OCC
Tpsa: 55.84
Logp: 1.2948
H Acceptors: 4
H Donors: 0
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:
C₉H₁₃ClFNO₄
Molecular Weight:
253.66
Synonyms:
None
SMILES:
O=C(N1[C@](C(OC)=O)(F)[C@@H](Cl)CC1)OCC
Tpsa:
55.84
Logp:
1.2948
H Acceptors:
4
H Donors:
0
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: C₁₁H₁₇N₃O₂
Molecular Weight: 223.27
Synonyms: 2-Methyl-2-propanyl 3-amino-5-cyclopropyl-1H-pyrazole-1-carboxylate
SMILES: O=C(N1N=C(C=C1C2CC2)N)OC(C)(C)C
Tpsa: 70.14
Logp: 2.1259
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₇N₃O₂
Molecular Weight:
223.27
Synonyms:
2-Methyl-2-propanyl 3-amino-5-cyclopropyl-1H-pyrazole-1-carboxylate
SMILES:
O=C(N1N=C(C=C1C2CC2)N)OC(C)(C)C
Tpsa:
70.14
Logp:
2.1259
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇BrF₃NO
Molecular Weight: 270.05
Synonyms: None
SMILES: FC(F)(C(C1=NC(Br)=CC=C1)(C)O)F
Tpsa: 33.12
Logp: 2.6139
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇BrF₃NO
Molecular Weight:
270.05
Synonyms:
None
SMILES:
FC(F)(C(C1=NC(Br)=CC=C1)(C)O)F
Tpsa:
33.12
Logp:
2.6139
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1