CS-1094421
Methyl 4-(1H-1,2,4-triazol-1-yl)but-2-enoate
Manufacturer: ChemScene
CAS Number: 338956-47-1
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Purity
90%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₇H₉N₃O₂
Molecular Weight
167.17
Synonyms
None
SMILES
O=C(OC)C=CCN1N=CN=C1
Tpsa
57.01
Logp
0.0073
H Acceptors
5
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: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉N₃O₂
Molecular Weight: 167.17
Synonyms: None
SMILES: O=C(OC)C=CCN1N=CN=C1
Tpsa: 57.01
Logp: 0.0073
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉N₃O₂
Molecular Weight:
167.17
Synonyms:
None
SMILES:
O=C(OC)C=CCN1N=CN=C1
Tpsa:
57.01
Logp:
0.0073
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₁F₃N₂O₃
Molecular Weight: 312.24
Synonyms: None
SMILES: O=C(N)C=1C(=NC=CC1OC)OC2=CC=CC(=C2)C(F)(F)F
Tpsa: 74.44
Logp: 3.0002
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₁F₃N₂O₃
Molecular Weight:
312.24
Synonyms:
None
SMILES:
O=C(N)C=1C(=NC=CC1OC)OC2=CC=CC(=C2)C(F)(F)F
Tpsa:
74.44
Logp:
3.0002
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₉N₃O₂S
Molecular Weight: 317.41
Synonyms: None
SMILES: O=C(OC)C=CC=1SC2=NC(=CC(=C2C1N=CN(C)C)C)C
Tpsa: 54.79
Logp: 3.32074
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₉N₃O₂S
Molecular Weight:
317.41
Synonyms:
None
SMILES:
O=C(OC)C=CC=1SC2=NC(=CC(=C2C1N=CN(C)C)C)C
Tpsa:
54.79
Logp:
3.32074
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₉F₃N₂O₂
Molecular Weight: 294.23
Synonyms: None
SMILES: N#CC=1C(=NC=CC1OC)OC2=CC=CC(=C2)C(F)(F)F
Tpsa: 55.14
Logp: 3.77298
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₉F₃N₂O₂
Molecular Weight:
294.23
Synonyms:
None
SMILES:
N#CC=1C(=NC=CC1OC)OC2=CC=CC(=C2)C(F)(F)F
Tpsa:
55.14
Logp:
3.77298
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3