CS-0884277
3-Oxo-2,3-dihydrobenzo[d]isoxazole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1526953-69-4
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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
C₈H₅NO₄
Molecular Weight
179.13
Synonyms
None
SMILES
O=C(C1=CC2=C(ONC2=O)C=C1)O
Tpsa
83.3
Logp
0.8193
H Acceptors
3
H Donors
2
Rotatable Bonds
1
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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: C₈H₅NO₄
Molecular Weight: 179.13
Synonyms: None
SMILES: O=C(C1=CC2=C(ONC2=O)C=C1)O
Tpsa: 83.3
Logp: 0.8193
H Acceptors: 3
H Donors: 2
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:
C₈H₅NO₄
Molecular Weight:
179.13
Synonyms:
None
SMILES:
O=C(C1=CC2=C(ONC2=O)C=C1)O
Tpsa:
83.3
Logp:
0.8193
H Acceptors:
3
H Donors:
2
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: C₈H₈FNO
Molecular Weight: 153.15
Synonyms: None
SMILES: CCC(C1=NC(F)=CC=C1)=O
Tpsa: 29.96
Logp: 1.8134
H Acceptors: 2
H Donors: 0
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:
C₈H₈FNO
Molecular Weight:
153.15
Synonyms:
None
SMILES:
CCC(C1=NC(F)=CC=C1)=O
Tpsa:
29.96
Logp:
1.8134
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₆F₂N₄
Molecular Weight: 148.11
Synonyms: None
SMILES: NC1=C(C(F)F)N(C)N=N1
Tpsa: 56.73
Logp: 0.3349
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₆F₂N₄
Molecular Weight:
148.11
Synonyms:
None
SMILES:
NC1=C(C(F)F)N(C)N=N1
Tpsa:
56.73
Logp:
0.3349
H Acceptors:
4
H Donors:
1
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: C₁₀H₆O₄
Molecular Weight: 190.15
Synonyms: None
SMILES: O=C(C1=CC=C2C(C(C=CO2)=O)=C1)O
Tpsa: 67.51
Logp: 1.4912
H Acceptors: 3
H Donors: 1
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:
C₁₀H₆O₄
Molecular Weight:
190.15
Synonyms:
None
SMILES:
O=C(C1=CC=C2C(C(C=CO2)=O)=C1)O
Tpsa:
67.51
Logp:
1.4912
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1