CS-0626828
Ethyl 3-bromo-1-(4-methoxybenzyl)-1H-1,2,4-triazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 2795110-31-3
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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
C₁₃H₁₄BrN₃O₃
Molecular Weight
340.17
Synonyms
None
SMILES
O=C(C1=NC(Br)=NN1CC2=CC=C(OC)C=C2)OCC
Tpsa
66.24
Logp
2.2742
H Acceptors
6
H Donors
0
Rotatable Bonds
5
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: C₁₃H₁₄BrN₃O₃
Molecular Weight: 340.17
Synonyms: None
SMILES: O=C(C1=NC(Br)=NN1CC2=CC=C(OC)C=C2)OCC
Tpsa: 66.24
Logp: 2.2742
H Acceptors: 6
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:
C₁₃H₁₄BrN₃O₃
Molecular Weight:
340.17
Synonyms:
None
SMILES:
O=C(C1=NC(Br)=NN1CC2=CC=C(OC)C=C2)OCC
Tpsa:
66.24
Logp:
2.2742
H Acceptors:
6
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: C₁₂H₁₃BrFN₃O
Molecular Weight: 314.15
Synonyms: None
SMILES: COC1=CC=C(CN2N=C(Br)N=C2C(F)C)C=C1
Tpsa: 39.94
Logp: 3.128
H Acceptors: 4
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:
C₁₂H₁₃BrFN₃O
Molecular Weight:
314.15
Synonyms:
None
SMILES:
COC1=CC=C(CN2N=C(Br)N=C2C(F)C)C=C1
Tpsa:
39.94
Logp:
3.128
H Acceptors:
4
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: C₁₂H₁₂BrF₂N₃O
Molecular Weight: 332.14
Synonyms: None
SMILES: COC1=CC=C(CN2N=C(Br)N=C2C(F)(F)C)C=C1
Tpsa: 39.94
Logp: 3.2092
H Acceptors: 4
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:
C₁₂H₁₂BrF₂N₃O
Molecular Weight:
332.14
Synonyms:
None
SMILES:
COC1=CC=C(CN2N=C(Br)N=C2C(F)(F)C)C=C1
Tpsa:
39.94
Logp:
3.2092
H Acceptors:
4
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:
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