CS-1066388
Methyl 5-oxo-2-(prop-2-yn-1-yl)-2,5-dihydro-1H-pyrazole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 2808490-34-6
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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
C₈H₈N₂O₃
Molecular Weight
180.16
Synonyms
None
SMILES
O=C(OC)C1=CC(=O)NN1CC#C
Tpsa
64.09
Logp
-0.4038
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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: C₈H₈N₂O₃
Molecular Weight: 180.16
Synonyms: None
SMILES: O=C(OC)C1=CC(=O)NN1CC#C
Tpsa: 64.09
Logp: -0.4038
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:
C₈H₈N₂O₃
Molecular Weight:
180.16
Synonyms:
None
SMILES:
O=C(OC)C1=CC(=O)NN1CC#C
Tpsa:
64.09
Logp:
-0.4038
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: C₉H₁₁F₃N₂O₂
Molecular Weight: 236.19
Synonyms: None
SMILES: O=C(O)C1=CN(N=C1C(F)(F)F)C(C)CC
Tpsa: 55.12
Logp: 2.5711
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:
C₉H₁₁F₃N₂O₂
Molecular Weight:
236.19
Synonyms:
None
SMILES:
O=C(O)C1=CN(N=C1C(F)(F)F)C(C)CC
Tpsa:
55.12
Logp:
2.5711
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₂ClF₂NO₂
Molecular Weight: 203.61
Synonyms: None
SMILES: Cl.FC1(F)CN(C)CCC1(O)O
Tpsa: 43.7
Logp: 0.0599
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₂ClF₂NO₂
Molecular Weight:
203.61
Synonyms:
None
SMILES:
Cl.FC1(F)CN(C)CCC1(O)O
Tpsa:
43.7
Logp:
0.0599
H Acceptors:
3
H Donors:
2
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: C₈H₁₄O
Molecular Weight: 126.20
Synonyms: None
SMILES: O1C2CCCC1CCC2
Tpsa: 9.23
Logp: 2.108
H Acceptors: 1
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:
C₈H₁₄O
Molecular Weight:
126.20
Synonyms:
None
SMILES:
O1C2CCCC1CCC2
Tpsa:
9.23
Logp:
2.108
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0