CS-0772529
4-Oxo-1H-imidazo[2,1-c][1,2,4]triazine-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 112298-49-4
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₆H₄N₄O₃
Molecular Weight
180.12
Synonyms
None
SMILES
OC(=O)C1=NNC2=NC=CN2C1=O
Tpsa
100.35
Logp
-0.8842
H Acceptors
5
H Donors
2
Rotatable Bonds
1
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₄N₄O₃
Molecular Weight: 180.12
Synonyms: None
SMILES: OC(=O)C1=NNC2=NC=CN2C1=O
Tpsa: 100.35
Logp: -0.8842
H Acceptors: 5
H Donors: 2
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:
C₆H₄N₄O₃
Molecular Weight:
180.12
Synonyms:
None
SMILES:
OC(=O)C1=NNC2=NC=CN2C1=O
Tpsa:
100.35
Logp:
-0.8842
H Acceptors:
5
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: C₈H₆BrFN₂O
Molecular Weight: 245.05
Synonyms: None
SMILES: NN1C(=O)CC2=C(F)C=C(Br)C=C12
Tpsa: 46.33
Logp: 1.351
H Acceptors: 2
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:
C₈H₆BrFN₂O
Molecular Weight:
245.05
Synonyms:
None
SMILES:
NN1C(=O)CC2=C(F)C=C(Br)C=C12
Tpsa:
46.33
Logp:
1.351
H Acceptors:
2
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: C₇H₄Br₃NO₂
Molecular Weight: 373.82
Synonyms: None
SMILES: [O-][N+](=O)C1=CC(C(Br)Br)=C(Br)C=C1
Tpsa: 43.14
Logp: 4.1457
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:
C₇H₄Br₃NO₂
Molecular Weight:
373.82
Synonyms:
None
SMILES:
[O-][N+](=O)C1=CC(C(Br)Br)=C(Br)C=C1
Tpsa:
43.14
Logp:
4.1457
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: C₈H₈FNO₃
Molecular Weight: 185.15
Synonyms: None
SMILES: COC(=O)C1=NC=C(F)C(OC)=C1
Tpsa: 48.42
Logp: 1.0159
H Acceptors: 4
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:
C₈H₈FNO₃
Molecular Weight:
185.15
Synonyms:
None
SMILES:
COC(=O)C1=NC=C(F)C(OC)=C1
Tpsa:
48.42
Logp:
1.0159
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2