CS-0914570
(S)-9,10-difluoro-2-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid
Manufacturer: ChemScene
CAS Number: 129798-65-8
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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
C₁₃H₉F₂NO₄
Molecular Weight
281.21
Synonyms
None
SMILES
O=C1C=2C3=C(C(F)=C(F)C2)O[C@@H](C)CN3C=C1C(O)=O
Tpsa
68.53
Logp
1.7588
H Acceptors
4
H Donors
1
Rotatable Bonds
1
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₃H₉F₂NO₄
Molecular Weight: 281.21
Synonyms: None
SMILES: O=C1C=2C3=C(C(F)=C(F)C2)O[C@@H](C)CN3C=C1C(O)=O
Tpsa: 68.53
Logp: 1.7588
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:
C₁₃H₉F₂NO₄
Molecular Weight:
281.21
Synonyms:
None
SMILES:
O=C1C=2C3=C(C(F)=C(F)C2)O[C@@H](C)CN3C=C1C(O)=O
Tpsa:
68.53
Logp:
1.7588
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: MFCD29066625
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂F₄O₄
Molecular Weight: 320.24
Synonyms: None
SMILES: O=C(OCC)C(=COCC)C(=O)C1=CC(F)=C(F)C(F)=C1F
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
MFCD29066625
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂F₄O₄
Molecular Weight:
320.24
Synonyms:
None
SMILES:
O=C(OCC)C(=COCC)C(=O)C1=CC(F)=C(F)C(F)=C1F
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₇N₃O₂
Molecular Weight: 223.27
Synonyms: None
SMILES: C(CC)N\1[C@H](CC(OC)=O)CC/C1=N\C#N
Tpsa: 65.69
Logp: 1.30348
H Acceptors: 4
H Donors: 0
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:
C₁₁H₁₇N₃O₂
Molecular Weight:
223.27
Synonyms:
None
SMILES:
C(CC)N\1[C@H](CC(OC)=O)CC/C1=N\C#N
Tpsa:
65.69
Logp:
1.30348
H Acceptors:
4
H Donors:
0
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: C₂₂H₂₉BrO₅
Molecular Weight: 453.37
Synonyms: None
SMILES: Br[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1O)[C@](C(CO)=O)(O)[C@@H](C)C3)[H])(CCC=4[C@]2(C)C=CC(=O)C4)[H]
Tpsa: 94.83
Logp: 2.3211
H Acceptors: 5
H Donors: 3
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:
C₂₂H₂₉BrO₅
Molecular Weight:
453.37
Synonyms:
None
SMILES:
Br[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1O)[C@](C(CO)=O)(O)[C@@H](C)C3)[H])(CCC=4[C@]2(C)C=CC(=O)C4)[H]
Tpsa:
94.83
Logp:
2.3211
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
2