CS-1009885
(E)-3-(4-Chloro-1H-imidazol-1-yl)acrylic acid
Manufacturer: ChemScene
CAS Number: 2660015-15-4
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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
C₆H₅ClN₂O₂
Molecular Weight
172.57
Synonyms
None
SMILES
O=C(O)C=CN1C=NC(Cl)=C1
Tpsa
55.12
Logp
1.0918
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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: C₆H₅ClN₂O₂
Molecular Weight: 172.57
Synonyms: None
SMILES: O=C(O)C=CN1C=NC(Cl)=C1
Tpsa: 55.12
Logp: 1.0918
H Acceptors: 3
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:
C₆H₅ClN₂O₂
Molecular Weight:
172.57
Synonyms:
None
SMILES:
O=C(O)C=CN1C=NC(Cl)=C1
Tpsa:
55.12
Logp:
1.0918
H Acceptors:
3
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: C₇H₅N₃O₂
Molecular Weight: 163.13
Synonyms: None
SMILES: N#CC1=NC=CN1C=CC(=O)O
Tpsa: 78.91
Logp: 0.31008
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:
C₇H₅N₃O₂
Molecular Weight:
163.13
Synonyms:
None
SMILES:
N#CC1=NC=CN1C=CC(=O)O
Tpsa:
78.91
Logp:
0.31008
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: C₁₀H₉BrFN
Molecular Weight: 242.09
Synonyms: None
SMILES: N#CC(C=1C=C(F)C=C(Br)C1)(C)C
Tpsa: 23.79
Logp: 3.38938
H Acceptors: 1
H Donors: 0
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:
C₁₀H₉BrFN
Molecular Weight:
242.09
Synonyms:
None
SMILES:
N#CC(C=1C=C(F)C=C(Br)C1)(C)C
Tpsa:
23.79
Logp:
3.38938
H Acceptors:
1
H Donors:
0
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: C₁₀H₁₀BrFO₃
Molecular Weight: 277.09
Synonyms: None
SMILES: [C@@H](CC(OC)=O)(O)C1=CC(Br)=CC(F)=C1
Tpsa: 46.53
Logp: 2.1847
H Acceptors: 3
H Donors: 1
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:
C₁₀H₁₀BrFO₃
Molecular Weight:
277.09
Synonyms:
None
SMILES:
[C@@H](CC(OC)=O)(O)C1=CC(Br)=CC(F)=C1
Tpsa:
46.53
Logp:
2.1847
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3