CS-0889667
2-(2-Cyano-5-methoxyphenyl)acetic acid
Manufacturer: ChemScene
CAS Number: 55086-19-6
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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
C₁₀H₉NO₃
Molecular Weight
191.18
Synonyms
None
SMILES
O=C(O)CC1=CC(OC)=CC=C1C#N
Tpsa
70.32
Logp
1.19398
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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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
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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: C₁₀H₉NO₃
Molecular Weight: 191.18
Synonyms: None
SMILES: O=C(O)CC1=CC(OC)=CC=C1C#N
Tpsa: 70.32
Logp: 1.19398
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:
C₁₀H₉NO₃
Molecular Weight:
191.18
Synonyms:
None
SMILES:
O=C(O)CC1=CC(OC)=CC=C1C#N
Tpsa:
70.32
Logp:
1.19398
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: C₇H₁₆N₂O₂
Molecular Weight: 160.21
Synonyms: None
SMILES: NCCCC[C@H](C(O)=O)NC
Tpsa: 75.35
Logp: -0.212
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₆N₂O₂
Molecular Weight:
160.21
Synonyms:
None
SMILES:
NCCCC[C@H](C(O)=O)NC
Tpsa:
75.35
Logp:
-0.212
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₀N₂O
Molecular Weight: 162.19
Synonyms: None
SMILES: N#CC1=CC=C(OC)C=C1CN
Tpsa: 59.04
Logp: 1.02558
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:
C₉H₁₀N₂O
Molecular Weight:
162.19
Synonyms:
None
SMILES:
N#CC1=CC=C(OC)C=C1CN
Tpsa:
59.04
Logp:
1.02558
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: C₃H₃F₂N₃
Molecular Weight: 119.07
Synonyms: None
SMILES: FC(N1C=NN=C1)F
Tpsa: 30.71
Logp: 0.6732
H Acceptors: 3
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:
C₃H₃F₂N₃
Molecular Weight:
119.07
Synonyms:
None
SMILES:
FC(N1C=NN=C1)F
Tpsa:
30.71
Logp:
0.6732
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1