CS-1061830
Methyl 2-(1-benzyl-3-oxo-2,3-dihydro-1H-pyrazol-4-yl)acetate
Manufacturer: ChemScene
CAS Number: 888739-84-2
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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
C₁₃H₁₄N₂O₃
Molecular Weight
246.26
Synonyms
None
SMILES
O=C(OC)CC1=CN(NC1=O)CC=2C=CC=CC2
Tpsa
64.09
Logp
0.9402
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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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: C₁₃H₁₄N₂O₃
Molecular Weight: 246.26
Synonyms: None
SMILES: O=C(OC)CC1=CN(NC1=O)CC=2C=CC=CC2
Tpsa: 64.09
Logp: 0.9402
H Acceptors: 4
H Donors: 1
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:
C₁₃H₁₄N₂O₃
Molecular Weight:
246.26
Synonyms:
None
SMILES:
O=C(OC)CC1=CN(NC1=O)CC=2C=CC=CC2
Tpsa:
64.09
Logp:
0.9402
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₃N₃O₃
Molecular Weight: 259.26
Synonyms: None
SMILES: N(/C=C(\C(NC(OCC)=O)=O)/C#N)C1=CC=CC=C1
Tpsa: 91.22
Logp: 1.77868
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 4
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃N₃O₃
Molecular Weight:
259.26
Synonyms:
None
SMILES:
N(/C=C(\C(NC(OCC)=O)=O)/C#N)C1=CC=CC=C1
Tpsa:
91.22
Logp:
1.77868
H Acceptors:
5
H Donors:
2
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: C₁₀H₉ClN₂O
Molecular Weight: 208.64
Synonyms: None
SMILES: ClC=1N=C2C=CC(=CC2=NC1OC)C
Tpsa: 35.01
Logp: 2.60022
H Acceptors: 3
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:
C₁₀H₉ClN₂O
Molecular Weight:
208.64
Synonyms:
None
SMILES:
ClC=1N=C2C=CC(=CC2=NC1OC)C
Tpsa:
35.01
Logp:
2.60022
H Acceptors:
3
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: C₉H₁₁NS
Molecular Weight: 165.26
Synonyms: None
SMILES: S1C2=C(C=C1C)NC(=C2C)C
Tpsa: 15.79
Logp: 3.15466
H Acceptors: 1
H Donors: 1
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:
C₉H₁₁NS
Molecular Weight:
165.26
Synonyms:
None
SMILES:
S1C2=C(C=C1C)NC(=C2C)C
Tpsa:
15.79
Logp:
3.15466
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0