CS-1058423
2-Amino-4-(3-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 876709-71-6
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Purity
90%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₆H₁₁FN₂O₄
Molecular Weight
314.27
Synonyms
None
SMILES
N#CC1=C(OC=2C(=O)C=C(OC2C1C=3C=CC=C(F)C3)CO)N
Tpsa
109.48
Logp
1.48938
H Acceptors
6
H Donors
2
Rotatable Bonds
2
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: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₁FN₂O₄
Molecular Weight: 314.27
Synonyms: None
SMILES: N#CC1=C(OC=2C(=O)C=C(OC2C1C=3C=CC=C(F)C3)CO)N
Tpsa: 109.48
Logp: 1.48938
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 2
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₁FN₂O₄
Molecular Weight:
314.27
Synonyms:
None
SMILES:
N#CC1=C(OC=2C(=O)C=C(OC2C1C=3C=CC=C(F)C3)CO)N
Tpsa:
109.48
Logp:
1.48938
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₃NO₃
Molecular Weight: 195.22
Synonyms: None
SMILES: O=C(OCC)C=1C=C(NC1C)C(=O)C
Tpsa: 59.16
Logp: 1.70242
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₃NO₃
Molecular Weight:
195.22
Synonyms:
None
SMILES:
O=C(OCC)C=1C=C(NC1C)C(=O)C
Tpsa:
59.16
Logp:
1.70242
H Acceptors:
3
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: C₆H₂F₆S
Molecular Weight: 220.14
Synonyms: None
SMILES: FC(F)(F)C=1SC=C(C1)C(F)(F)F
Tpsa: 0
Logp: 3.7857
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:
C₆H₂F₆S
Molecular Weight:
220.14
Synonyms:
None
SMILES:
FC(F)(F)C=1SC=C(C1)C(F)(F)F
Tpsa:
0
Logp:
3.7857
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁ClN₂O₄S
Molecular Weight: 278.71
Synonyms: None
SMILES: O=C(OCCCl)NS(=O)(=O)NC=1C=CC=CC1
Tpsa: 84.5
Logp: 1.3083
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁ClN₂O₄S
Molecular Weight:
278.71
Synonyms:
None
SMILES:
O=C(OCCCl)NS(=O)(=O)NC=1C=CC=CC1
Tpsa:
84.5
Logp:
1.3083
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5