CS-1043908
3-Oxo-3-(pyridin-3-yl)propanenitrile oxalate
Manufacturer: ChemScene
CAS Number: 1955493-79-4
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₀H₈N₂O₅
Molecular Weight
236.18
Synonyms
None
SMILES
N#CCC(=O)C=1C=NC=CC1.O=C(O)C(=O)O
Tpsa
128.35
Logp
0.33358
H Acceptors
5
H Donors
2
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
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈N₂O₅
Molecular Weight: 236.18
Synonyms: None
SMILES: N#CCC(=O)C=1C=NC=CC1.O=C(O)C(=O)O
Tpsa: 128.35
Logp: 0.33358
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₈N₂O₅
Molecular Weight:
236.18
Synonyms:
None
SMILES:
N#CCC(=O)C=1C=NC=CC1.O=C(O)C(=O)O
Tpsa:
128.35
Logp:
0.33358
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₃ClFNO₂
Molecular Weight: 233.67
Synonyms: None
SMILES: Cl.FC1=CC=C2OCC(NC2=C1)CCO
Tpsa: 41.49
Logp: 1.8028
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₃ClFNO₂
Molecular Weight:
233.67
Synonyms:
None
SMILES:
Cl.FC1=CC=C2OCC(NC2=C1)CCO
Tpsa:
41.49
Logp:
1.8028
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₉ClN₂O
Molecular Weight: 194.70
Synonyms: None
SMILES: Cl.O=C(N(C)C)C(N)C(C)(C)C
Tpsa: 46.33
Logp: 0.8698
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₉ClN₂O
Molecular Weight:
194.70
Synonyms:
None
SMILES:
Cl.O=C(N(C)C)C(N)C(C)(C)C
Tpsa:
46.33
Logp:
0.8698
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉ClFNO₂S
Molecular Weight: 225.67
Synonyms: None
SMILES: Cl.O=S(=O)(C1=CC(N)=CC=C1F)C
Tpsa: 60.16
Logp: 1.2332
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉ClFNO₂S
Molecular Weight:
225.67
Synonyms:
None
SMILES:
Cl.O=S(=O)(C1=CC(N)=CC=C1F)C
Tpsa:
60.16
Logp:
1.2332
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1