CS-1046688
1-Chloro-8-fluoropyrrolo[1,2-d][1,2,4]triazin-4(3H)-one
Manufacturer: ChemScene
CAS Number: 2925076-25-9
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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
C₆H₃ClFN₃O
Molecular Weight
187.56
Synonyms
None
SMILES
O=C1NN=C(Cl)C2=C(F)C=CN12
Tpsa
50.16
Logp
0.8151
H Acceptors
3
H Donors
1
Rotatable Bonds
0
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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: C₆H₃ClFN₃O
Molecular Weight: 187.56
Synonyms: None
SMILES: O=C1NN=C(Cl)C2=C(F)C=CN12
Tpsa: 50.16
Logp: 0.8151
H Acceptors: 3
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:
C₆H₃ClFN₃O
Molecular Weight:
187.56
Synonyms:
None
SMILES:
O=C1NN=C(Cl)C2=C(F)C=CN12
Tpsa:
50.16
Logp:
0.8151
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₁BrN₂O₄
Molecular Weight: 351.15
Synonyms: None
SMILES: O=C1N(C(CC2)C(NC2=O)=O)C(C3=C1C=CC=C3CBr)=O
Tpsa: 83.55
Logp: 0.9827
H Acceptors: 4
H Donors: 1
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:
C₁₄H₁₁BrN₂O₄
Molecular Weight:
351.15
Synonyms:
None
SMILES:
O=C1N(C(CC2)C(NC2=O)=O)C(C3=C1C=CC=C3CBr)=O
Tpsa:
83.55
Logp:
0.9827
H Acceptors:
4
H Donors:
1
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: C₉H₁₀BrNO₂
Molecular Weight: 244.09
Synonyms: None
SMILES: O=[N+](C1=C(C)C(Br)=C(C)C(C)=C1)[O-]
Tpsa: 43.14
Logp: 3.28256
H Acceptors: 2
H Donors: 0
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:
C₉H₁₀BrNO₂
Molecular Weight:
244.09
Synonyms:
None
SMILES:
O=[N+](C1=C(C)C(Br)=C(C)C(C)=C1)[O-]
Tpsa:
43.14
Logp:
3.28256
H Acceptors:
2
H Donors:
0
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: C₁₈H₂₄BClN₂O₃
Molecular Weight: 362.66
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CC(Cl)=CC3=C2C=NN3C4CCCCO4)O1
Tpsa: 45.51
Logp: 3.688
H Acceptors: 5
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:
C₁₈H₂₄BClN₂O₃
Molecular Weight:
362.66
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CC(Cl)=CC3=C2C=NN3C4CCCCO4)O1
Tpsa:
45.51
Logp:
3.688
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2