CS-1062544
1-(3-Ethyl-5-hydroxy-1H-pyrazol-1-yl)butan-1-one
Manufacturer: ChemScene
CAS Number: 2557723-40-5
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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
C₉H₁₄N₂O₂
Molecular Weight
182.22
Synonyms
None
SMILES
O=C(N1N=C(C=C1O)CC)CCC
Tpsa
55.12
Logp
1.5914
H Acceptors
4
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: O=C(N1N=C(C=C1O)CC)CCC
Tpsa: 55.12
Logp: 1.5914
H Acceptors: 4
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:
O=C(N1N=C(C=C1O)CC)CCC
Tpsa:
55.12
Logp:
1.5914
H Acceptors:
4
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: C₅H₁₁NO₃
Molecular Weight: 133.15
Synonyms: None
SMILES: O=C(O)CCC(O)CN
Tpsa: 83.55
Logp: -0.8292
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₁NO₃
Molecular Weight:
133.15
Synonyms:
None
SMILES:
O=C(O)CCC(O)CN
Tpsa:
83.55
Logp:
-0.8292
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₅F₃S
Molecular Weight: 166.16
Synonyms: None
SMILES: FC(F)(F)C=1SC(=CC1)C
Tpsa: 0
Logp: 3.07532
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:
C₆H₅F₃S
Molecular Weight:
166.16
Synonyms:
None
SMILES:
FC(F)(F)C=1SC(=CC1)C
Tpsa:
0
Logp:
3.07532
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: C₇H₁₄N₂
Molecular Weight: 126.20
Synonyms: None
SMILES: C1(=C(N(C)CN1C)C)C
Tpsa: 6.48
Logp: 1.0725
H Acceptors: 2
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:
C₇H₁₄N₂
Molecular Weight:
126.20
Synonyms:
None
SMILES:
C1(=C(N(C)CN1C)C)C
Tpsa:
6.48
Logp:
1.0725
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0