CS-1061948
5-Oxo-2-(pyridin-3-ylmethylene)pyrazolidin-2-ium-1-ide
Manufacturer: ChemScene
CAS Number: 84198-94-7
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Purity
90%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₉N₃O
Molecular Weight
175.19
Synonyms
None
SMILES
O=C1[N-][N+](=CC=2C=NC=CC2)CC1
Tpsa
47.07
Logp
0.732
H Acceptors
2
H Donors
0
Rotatable Bonds
1
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: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉N₃O
Molecular Weight: 175.19
Synonyms: None
SMILES: O=C1[N-][N+](=CC=2C=NC=CC2)CC1
Tpsa: 47.07
Logp: 0.732
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉N₃O
Molecular Weight:
175.19
Synonyms:
None
SMILES:
O=C1[N-][N+](=CC=2C=NC=CC2)CC1
Tpsa:
47.07
Logp:
0.732
H Acceptors:
2
H Donors:
0
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: C₁₂H₁₉NO₃
Molecular Weight: 225.28
Synonyms: None
SMILES: O=C(OCC)C1=NOC(=C1)CCCCCC
Tpsa: 52.33
Logp: 2.9741
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₉NO₃
Molecular Weight:
225.28
Synonyms:
None
SMILES:
O=C(OCC)C1=NOC(=C1)CCCCCC
Tpsa:
52.33
Logp:
2.9741
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₈O₃
Molecular Weight: 174.24
Synonyms: None
SMILES: OCCC1(OCC(C)(C)CO1)C
Tpsa: 38.69
Logp: 1.158
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:
C₉H₁₈O₃
Molecular Weight:
174.24
Synonyms:
None
SMILES:
OCCC1(OCC(C)(C)CO1)C
Tpsa:
38.69
Logp:
1.158
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₂N₂OS
Molecular Weight: 184.26
Synonyms: None
SMILES: N=1C=CC(=NC1SCC)OCC
Tpsa: 35.01
Logp: 1.9873
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₂N₂OS
Molecular Weight:
184.26
Synonyms:
None
SMILES:
N=1C=CC(=NC1SCC)OCC
Tpsa:
35.01
Logp:
1.9873
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4