CS-1023259
3-(1-Methyl-1H-imidazol-5-yl)propiolic acid
Manufacturer: ChemScene
CAS Number: 1690596-76-9
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₇H₆N₂O₂
Molecular Weight
150.13
Synonyms
None
SMILES
O=C(O)C#CC1=CN=CN1C
Tpsa
55.12
Logp
-0.1438
H Acceptors
3
H Donors
1
Rotatable Bonds
0
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆N₂O₂
Molecular Weight: 150.13
Synonyms: None
SMILES: O=C(O)C#CC1=CN=CN1C
Tpsa: 55.12
Logp: -0.1438
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆N₂O₂
Molecular Weight:
150.13
Synonyms:
None
SMILES:
O=C(O)C#CC1=CN=CN1C
Tpsa:
55.12
Logp:
-0.1438
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₂N₂OS
Molecular Weight: 172.25
Synonyms: None
SMILES: N1=C(SC=C1C(OC)(C)C)N
Tpsa: 48.14
Logp: 1.6068
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₂N₂OS
Molecular Weight:
172.25
Synonyms:
None
SMILES:
N1=C(SC=C1C(OC)(C)C)N
Tpsa:
48.14
Logp:
1.6068
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₀N₂O₂S
Molecular Weight: 280.39
Synonyms: None
SMILES: O=S1(=O)CC2NCC(CN(CC=3C=CC=CC3)C2)C1
Tpsa: 49.41
Logp: 0.505
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₀N₂O₂S
Molecular Weight:
280.39
Synonyms:
None
SMILES:
O=S1(=O)CC2NCC(CN(CC=3C=CC=CC3)C2)C1
Tpsa:
49.41
Logp:
0.505
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₈N₂O₃S
Molecular Weight: 294.37
Synonyms: None
SMILES: O=C1NC2CN(CC=3C=CC=CC3)CC1CS(=O)(=O)C2
Tpsa: 66.48
Logp: 0.0316
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₈N₂O₃S
Molecular Weight:
294.37
Synonyms:
None
SMILES:
O=C1NC2CN(CC=3C=CC=CC3)CC1CS(=O)(=O)C2
Tpsa:
66.48
Logp:
0.0316
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2