CS-0530972
1-(5-Bromo-4H-1,2,4-triazol-3-yl)ethanone
Manufacturer: ChemScene
CAS Number: 1780810-73-2
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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
C₄H₄BrN₃O
Molecular Weight
190.00
Synonyms
None
SMILES
O=C(C)C1=NN=C(N1)Br
Tpsa
58.64
Logp
0.7698
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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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: C₄H₄BrN₃O
Molecular Weight: 190.00
Synonyms: None
SMILES: O=C(C)C1=NN=C(N1)Br
Tpsa: 58.64
Logp: 0.7698
H Acceptors: 3
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:
C₄H₄BrN₃O
Molecular Weight:
190.00
Synonyms:
None
SMILES:
O=C(C)C1=NN=C(N1)Br
Tpsa:
58.64
Logp:
0.7698
H Acceptors:
3
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: C₁₀H₁₄N₂O
Molecular Weight: 178.23
Synonyms: None
SMILES: NC1=C(C=C2C(CNCC2)=C1)OC
Tpsa: 47.28
Logp: 0.9231
H Acceptors: 3
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:
C₁₀H₁₄N₂O
Molecular Weight:
178.23
Synonyms:
None
SMILES:
NC1=C(C=C2C(CNCC2)=C1)OC
Tpsa:
47.28
Logp:
0.9231
H Acceptors:
3
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: C₁₅H₂₁BClNO₄
Molecular Weight: 325.60
Synonyms: None
SMILES: O=C(CCC1=CC(Cl)=NC=C1B2OC(C)(C(C)(C)O2)C)OC
Tpsa: 57.65
Logp: 2.1398
H Acceptors: 5
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:
C₁₅H₂₁BClNO₄
Molecular Weight:
325.60
Synonyms:
None
SMILES:
O=C(CCC1=CC(Cl)=NC=C1B2OC(C)(C(C)(C)O2)C)OC
Tpsa:
57.65
Logp:
2.1398
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD22418639
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₃Br₂N₃O
Molecular Weight: 280.90
Synonyms: 3,6-Dibromo-2-pyrazinecarboxamide
SMILES: O=C(C1=NC(Br)=CN=C1Br)N
Tpsa: 68.87
Logp: 1.1005
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD22418639
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₃Br₂N₃O
Molecular Weight:
280.90
Synonyms:
3,6-Dibromo-2-pyrazinecarboxamide
SMILES:
O=C(C1=NC(Br)=CN=C1Br)N
Tpsa:
68.87
Logp:
1.1005
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1