CS-0343311
1-(2-Methyl-5-nitro-1H-imidazol-1-yl)propan-2-one
Manufacturer: ChemScene
CAS Number: 31876-69-4
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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
2-Propanone, 1-(2-methyl-5-nitroimidazol-1-yl)-
SMILES
CC(CN1C([N+]([O-])=O)=CN=C1C)=O
Tpsa
78.03
Logp
0.68872
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
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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: 2-Propanone, 1-(2-methyl-5-nitroimidazol-1-yl)-
SMILES: CC(CN1C([N+]([O-])=O)=CN=C1C)=O
Tpsa: 78.03
Logp: 0.68872
H Acceptors: 5
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:
2-Propanone, 1-(2-methyl-5-nitroimidazol-1-yl)-
SMILES:
CC(CN1C([N+]([O-])=O)=CN=C1C)=O
Tpsa:
78.03
Logp:
0.68872
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD19160634
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₉NO₃
Molecular Weight: 143.14
Synonyms: None
SMILES: CC(N[C@@H]1C(OCC1)=O)=O
Tpsa: 55.4
Logp: -0.562
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD19160634
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₉NO₃
Molecular Weight:
143.14
Synonyms:
None
SMILES:
CC(N[C@@H]1C(OCC1)=O)=O
Tpsa:
55.4
Logp:
-0.562
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: MFCD04115605
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₇NO₄
Molecular Weight: 215.25
Synonyms: None
SMILES: O=C(O)CC(CC1)(N)CCC21OCCO2
Tpsa: 81.78
Logp: 0.4757
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
97%
MDL No:
MFCD04115605
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₇NO₄
Molecular Weight:
215.25
Synonyms:
None
SMILES:
O=C(O)CC(CC1)(N)CCC21OCCO2
Tpsa:
81.78
Logp:
0.4757
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆N₂O₂
Molecular Weight: 150.13
Synonyms: 1H-Pyrrole-2-carboxylicacid,4-cyano-,methylester(9CI)
SMILES: O=C(C1=CC(C#N)=CN1)OC
Tpsa: 65.88
Logp: 0.67298
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆N₂O₂
Molecular Weight:
150.13
Synonyms:
1H-Pyrrole-2-carboxylicacid,4-cyano-,methylester(9CI)
SMILES:
O=C(C1=CC(C#N)=CN1)OC
Tpsa:
65.88
Logp:
0.67298
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1