CS-0871361
3-(3-Chloro-2-fluorophenyl)-3-oxopropanenitrile
Manufacturer: ChemScene
CAS Number: 1290181-18-8
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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
C₉H₅ClFNO
Molecular Weight
197.59
Synonyms
None
SMILES
C1=CC(=C(C(=C1)Cl)F)C(=O)CC#N
Tpsa
40.86
Logp
2.57548
H Acceptors
2
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1290181-18-8 | 3-Chloro-2-fluorobenzoylacetonitrile | A2B Chem | -- |
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₉H₅ClFNO
Molecular Weight: 197.59
Synonyms: None
SMILES: C1=CC(=C(C(=C1)Cl)F)C(=O)CC#N
Tpsa: 40.86
Logp: 2.57548
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:
C₉H₅ClFNO
Molecular Weight:
197.59
Synonyms:
None
SMILES:
C1=CC(=C(C(=C1)Cl)F)C(=O)CC#N
Tpsa:
40.86
Logp:
2.57548
H Acceptors:
2
H Donors:
0
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: C₁₂H₁₇NO₂
Molecular Weight: 207.27
Synonyms: None
SMILES: O=C(OC)CC(N)CCC1=CC=CC=C1
Tpsa: 52.32
Logp: 1.5096
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₇NO₂
Molecular Weight:
207.27
Synonyms:
None
SMILES:
O=C(OC)CC(N)CCC1=CC=CC=C1
Tpsa:
52.32
Logp:
1.5096
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₂₈O₅S
Molecular Weight: 452.56
Synonyms: None
SMILES: C1=CC=C(C=C1)CO[C@H]2[C@@H]([C@H](O[C@H]([C@@H]2OCC3=CC=CC=C3)SC4=CC=CC=C4)CO)O
Tpsa: 68.15
Logp: 4.0276
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₂₈O₅S
Molecular Weight:
452.56
Synonyms:
None
SMILES:
C1=CC=C(C=C1)CO[C@H]2[C@@H]([C@H](O[C@H]([C@@H]2OCC3=CC=CC=C3)SC4=CC=CC=C4)CO)O
Tpsa:
68.15
Logp:
4.0276
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
9
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₃N₃
Molecular Weight: 175.23
Synonyms: None
SMILES: C1CNC(=NC1)C2=CC=C(C=C2)N
Tpsa: 50.41
Logp: 1.0087
H Acceptors: 3
H Donors: 2
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:
C₁₀H₁₃N₃
Molecular Weight:
175.23
Synonyms:
None
SMILES:
C1CNC(=NC1)C2=CC=C(C=C2)N
Tpsa:
50.41
Logp:
1.0087
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1