CS-0626831
1-(3-Bromo-1-(4-methoxybenzyl)-1H-1,2,4-triazol-5-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 2795110-12-0
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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
C₁₂H₁₂BrN₃O₂
Molecular Weight
310.15
Synonyms
None
SMILES
CC(C1=NC(Br)=NN1CC2=CC=C(OC)C=C2)=O
Tpsa
57.01
Logp
2.3001
H Acceptors
5
H Donors
0
Rotatable Bonds
4
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: C₁₂H₁₂BrN₃O₂
Molecular Weight: 310.15
Synonyms: None
SMILES: CC(C1=NC(Br)=NN1CC2=CC=C(OC)C=C2)=O
Tpsa: 57.01
Logp: 2.3001
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:
C₁₂H₁₂BrN₃O₂
Molecular Weight:
310.15
Synonyms:
None
SMILES:
CC(C1=NC(Br)=NN1CC2=CC=C(OC)C=C2)=O
Tpsa:
57.01
Logp:
2.3001
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: C₁₁H₉BrF₃N₃O
Molecular Weight: 336.11
Synonyms: None
SMILES: FC(C1=NC(Br)=NN1CC2=CC=C(OC)C=C2)(F)F
Tpsa: 39.94
Logp: 3.1163
H Acceptors: 4
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:
C₁₁H₉BrF₃N₃O
Molecular Weight:
336.11
Synonyms:
None
SMILES:
FC(C1=NC(Br)=NN1CC2=CC=C(OC)C=C2)(F)F
Tpsa:
39.94
Logp:
3.1163
H Acceptors:
4
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: C₁₂H₁₅ClFNOSi
Molecular Weight: 271.79
Synonyms: None
SMILES: NC1=C(C#C[Si](C)(C)C)C=C(OC)C(Cl)=C1F
Tpsa: 35.25
Logp: 3.2988
H Acceptors: 2
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:
C₁₂H₁₅ClFNOSi
Molecular Weight:
271.79
Synonyms:
None
SMILES:
NC1=C(C#C[Si](C)(C)C)C=C(OC)C(Cl)=C1F
Tpsa:
35.25
Logp:
3.2988
H Acceptors:
2
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: C₇H₆BrClFNO
Molecular Weight: 254.48
Synonyms: None
SMILES: NC1=C(Br)C=C(OC)C(Cl)=C1F
Tpsa: 35.25
Logp: 2.8324
H Acceptors: 2
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:
C₇H₆BrClFNO
Molecular Weight:
254.48
Synonyms:
None
SMILES:
NC1=C(Br)C=C(OC)C(Cl)=C1F
Tpsa:
35.25
Logp:
2.8324
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1