CS-1085039
Ethyl 3-formyl-1-methyl-1H-1,2,4-triazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 2932440-04-3
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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
C₇H₉N₃O₃
Molecular Weight
183.16
Synonyms
None
SMILES
O=CC=1N=C(C(=O)OCC)N(N1)C
Tpsa
74.08
Logp
-0.1957
H Acceptors
6
H Donors
0
Rotatable Bonds
3
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: C₇H₉N₃O₃
Molecular Weight: 183.16
Synonyms: None
SMILES: O=CC=1N=C(C(=O)OCC)N(N1)C
Tpsa: 74.08
Logp: -0.1957
H Acceptors: 6
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:
C₇H₉N₃O₃
Molecular Weight:
183.16
Synonyms:
None
SMILES:
O=CC=1N=C(C(=O)OCC)N(N1)C
Tpsa:
74.08
Logp:
-0.1957
H Acceptors:
6
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: C₇H₄BrClN₂
Molecular Weight: 231.48
Synonyms: None
SMILES: ClC1=CC=NN2C(Br)=CC=C12
Tpsa: 17.3
Logp: 2.7502
H Acceptors: 2
H Donors: 0
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:
C₇H₄BrClN₂
Molecular Weight:
231.48
Synonyms:
None
SMILES:
ClC1=CC=NN2C(Br)=CC=C12
Tpsa:
17.3
Logp:
2.7502
H Acceptors:
2
H Donors:
0
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: C₆H₅ClN₂O₃
Molecular Weight: 188.57
Synonyms: None
SMILES: O=C(O)C1=NC=C(OC)C(Cl)=N1
Tpsa: 72.31
Logp: 0.8368
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:
C₆H₅ClN₂O₃
Molecular Weight:
188.57
Synonyms:
None
SMILES:
O=C(O)C1=NC=C(OC)C(Cl)=N1
Tpsa:
72.31
Logp:
0.8368
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: C₉H₁₂F₂O₂
Molecular Weight: 190.19
Synonyms: None
SMILES: O=C(O)C12CCCC(C1)(C2)C(F)F
Tpsa: 37.3
Logp: 2.2866
H Acceptors: 1
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:
C₉H₁₂F₂O₂
Molecular Weight:
190.19
Synonyms:
None
SMILES:
O=C(O)C12CCCC(C1)(C2)C(F)F
Tpsa:
37.3
Logp:
2.2866
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2