CS-0769496
5-Cyano-2-Isopropoxybenzoic acid
Manufacturer: ChemScene
CAS Number: 845616-14-0
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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
C₁₁H₁₁NO₃
Molecular Weight
205.21
Synonyms
None
SMILES
CC(C)OC1=C(C=C(C=C1)C#N)C(O)=O
Tpsa
70.32
Logp
2.04368
H Acceptors
3
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 5-cyano-2-isopropoxybenzoic acid | Aaron Chemicals LLC | ₹ 42,780.00 - ₹ 68,448.00 | |
 | 845616-14-0 | 5-cyano-2-isopropoxybenzoic acid | A2B Chem | -- |
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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₁NO₃
Molecular Weight: 205.21
Synonyms: None
SMILES: CC(C)OC1=C(C=C(C=C1)C#N)C(O)=O
Tpsa: 70.32
Logp: 2.04368
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₁NO₃
Molecular Weight:
205.21
Synonyms:
None
SMILES:
CC(C)OC1=C(C=C(C=C1)C#N)C(O)=O
Tpsa:
70.32
Logp:
2.04368
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: C₉H₄ClN₃O₄
Molecular Weight: 253.60
Synonyms: None
SMILES: [O-][N+](=O)C1=CC(=C2N=C(Cl)C=CC2=C1)[N+]([O-])=O
Tpsa: 99.17
Logp: 2.7046
H Acceptors: 5
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:
C₉H₄ClN₃O₄
Molecular Weight:
253.60
Synonyms:
None
SMILES:
[O-][N+](=O)C1=CC(=C2N=C(Cl)C=CC2=C1)[N+]([O-])=O
Tpsa:
99.17
Logp:
2.7046
H Acceptors:
5
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: C₁₁H₁₅N₃O₂
Molecular Weight: 221.26
Synonyms: None
SMILES: [O-][N+](=O)C1=CC=C(NC2CCNCC2)C=C1
Tpsa: 67.2
Logp: 1.7587
H Acceptors: 4
H Donors: 2
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:
C₁₁H₁₅N₃O₂
Molecular Weight:
221.26
Synonyms:
None
SMILES:
[O-][N+](=O)C1=CC=C(NC2CCNCC2)C=C1
Tpsa:
67.2
Logp:
1.7587
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈Cl₂O
Molecular Weight: 203.07
Synonyms: None
SMILES: CC(Cl)C(=O)C1=CC(Cl)=CC=C1
Tpsa: 17.07
Logp: 3.15
H Acceptors: 1
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:
C₉H₈Cl₂O
Molecular Weight:
203.07
Synonyms:
None
SMILES:
CC(Cl)C(=O)C1=CC(Cl)=CC=C1
Tpsa:
17.07
Logp:
3.15
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2