CS-1148366
1-Methyl-5-nitro-1H-imidazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 109540-97-8
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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
C₅H₅N₃O₄
Molecular Weight
171.11
Synonyms
None
SMILES
O=C(O)C=1N=CN(C1N(=O)=O)C
Tpsa
98.26
Logp
0.0265
H Acceptors
5
H Donors
1
Rotatable Bonds
2
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₅N₃O₄
Molecular Weight: 171.11
Synonyms: None
SMILES: O=C(O)C=1N=CN(C1N(=O)=O)C
Tpsa: 98.26
Logp: 0.0265
H Acceptors: 5
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:
C₅H₅N₃O₄
Molecular Weight:
171.11
Synonyms:
None
SMILES:
O=C(O)C=1N=CN(C1N(=O)=O)C
Tpsa:
98.26
Logp:
0.0265
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₁NO₂
Molecular Weight: 201.23
Synonyms: None
SMILES: O=CC=1NC=CC1OCC=2C=CC=CC2
Tpsa: 42.09
Logp: 2.4062
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₁NO₂
Molecular Weight:
201.23
Synonyms:
None
SMILES:
O=CC=1NC=CC1OCC=2C=CC=CC2
Tpsa:
42.09
Logp:
2.4062
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉BrO₂
Molecular Weight: 229.07
Synonyms: None
SMILES: O=C(O)C1=C(Br)C(=CC=C1C)C
Tpsa: 37.3
Logp: 2.76414
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉BrO₂
Molecular Weight:
229.07
Synonyms:
None
SMILES:
O=C(O)C1=C(Br)C(=CC=C1C)C
Tpsa:
37.3
Logp:
2.76414
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇ClFNO
Molecular Weight: 199.61
Synonyms: None
SMILES: N#CCC=1C=C(OC)C(Cl)=CC1F
Tpsa: 33.02
Logp: 2.55378
H Acceptors: 2
H Donors: 0
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:
C₉H₇ClFNO
Molecular Weight:
199.61
Synonyms:
None
SMILES:
N#CCC=1C=C(OC)C(Cl)=CC1F
Tpsa:
33.02
Logp:
2.55378
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2