CS-1063318
3-(5-Methyl-7-oxo-3,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propiolic acid
Manufacturer: ChemScene
CAS Number: 2576870-27-2
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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
C₉H₆N₄O₃
Molecular Weight
218.17
Synonyms
None
SMILES
O=C(O)C#CC=1C(=O)N2N=CNC2=NC1C
Tpsa
100.35
Logp
-0.83788
H Acceptors
5
H Donors
2
Rotatable Bonds
0
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: C₉H₆N₄O₃
Molecular Weight: 218.17
Synonyms: None
SMILES: O=C(O)C#CC=1C(=O)N2N=CNC2=NC1C
Tpsa: 100.35
Logp: -0.83788
H Acceptors: 5
H Donors: 2
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:
C₉H₆N₄O₃
Molecular Weight:
218.17
Synonyms:
None
SMILES:
O=C(O)C#CC=1C(=O)N2N=CNC2=NC1C
Tpsa:
100.35
Logp:
-0.83788
H Acceptors:
5
H Donors:
2
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: C₁₄H₁₅NO₃
Molecular Weight: 245.27
Synonyms: None
SMILES: O=C(OC)C=1C=CC=2N=C(C=CC2C1)CCCO
Tpsa: 59.42
Logp: 1.9463
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:
C₁₄H₁₅NO₃
Molecular Weight:
245.27
Synonyms:
None
SMILES:
O=C(OC)C=1C=CC=2N=C(C=CC2C1)CCCO
Tpsa:
59.42
Logp:
1.9463
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: C₁₃H₁₅BrN₂
Molecular Weight: 279.18
Synonyms: None
SMILES: BrCCCCCC=1C=NC2=CC=CN=C2C1
Tpsa: 25.78
Logp: 3.7375
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅BrN₂
Molecular Weight:
279.18
Synonyms:
None
SMILES:
BrCCCCCC=1C=NC2=CC=CN=C2C1
Tpsa:
25.78
Logp:
3.7375
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₈FNO₂
Molecular Weight: 275.32
Synonyms: None
SMILES: O=C(OCC)C1=NC=2C=CC=C(F)C2C(=C1C(C)C)C
Tpsa: 39.19
Logp: 3.98242
H Acceptors: 3
H Donors: 0
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:
C₁₆H₁₈FNO₂
Molecular Weight:
275.32
Synonyms:
None
SMILES:
O=C(OCC)C1=NC=2C=CC=C(F)C2C(=C1C(C)C)C
Tpsa:
39.19
Logp:
3.98242
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3