CS-0514140
Ethyl 3-oxo-2,3-dihydrobenzo[d]isoxazole-6-carboxylate
Manufacturer: ChemScene
CAS Number: 2090849-75-3
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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
C₁₀H₉NO₄
Molecular Weight
207.18
Synonyms
None
SMILES
O=C(C1=CC(ON2)=C(C=C1)C2=O)OCC
Tpsa
72.3
Logp
1.2978
H Acceptors
4
H Donors
1
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₉NO₄
Molecular Weight: 207.18
Synonyms: None
SMILES: O=C(C1=CC(ON2)=C(C=C1)C2=O)OCC
Tpsa: 72.3
Logp: 1.2978
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:
C₁₀H₉NO₄
Molecular Weight:
207.18
Synonyms:
None
SMILES:
O=C(C1=CC(ON2)=C(C=C1)C2=O)OCC
Tpsa:
72.3
Logp:
1.2978
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: C₁₃H₁₉FN₂O₂
Molecular Weight: 254.30
Synonyms: None
SMILES: C[C@@H](C1=C(C=CC(NC(OC(C)(C)C)=O)=C1)F)N
Tpsa: 64.35
Logp: 3.1924
H Acceptors: 3
H Donors: 2
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:
C₁₃H₁₉FN₂O₂
Molecular Weight:
254.30
Synonyms:
None
SMILES:
C[C@@H](C1=C(C=CC(NC(OC(C)(C)C)=O)=C1)F)N
Tpsa:
64.35
Logp:
3.1924
H Acceptors:
3
H Donors:
2
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: C₈H₁₂N₂S
Molecular Weight: 168.26
Synonyms: None
SMILES: NC1=NC(CC[C@H](C)C2)=C2S1
Tpsa: 38.91
Logp: 1.8501
H Acceptors: 3
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:
C₈H₁₂N₂S
Molecular Weight:
168.26
Synonyms:
None
SMILES:
NC1=NC(CC[C@H](C)C2)=C2S1
Tpsa:
38.91
Logp:
1.8501
H Acceptors:
3
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: C₁₀H₁₂N₂O₄
Molecular Weight: 224.21
Synonyms: None
SMILES: NC[C@@H](C1=C2C(NC(CO2)=O)=CC(O)=C1)O
Tpsa: 104.81
Logp: -0.2848
H Acceptors: 5
H Donors: 4
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:
C₁₀H₁₂N₂O₄
Molecular Weight:
224.21
Synonyms:
None
SMILES:
NC[C@@H](C1=C2C(NC(CO2)=O)=CC(O)=C1)O
Tpsa:
104.81
Logp:
-0.2848
H Acceptors:
5
H Donors:
4
Rotatable Bonds:
2