CS-0767547
2-(5-Methoxy-1-Methyl-1H-indol-3-yl)acetonitrile
Manufacturer: ChemScene
CAS Number: 176688-98-5
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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
C₁₂H₁₂N₂O
Molecular Weight
200.24
Synonyms
None
SMILES
COC1=CC=C2N(C)C=C(CC#N)C2=C1
Tpsa
37.95
Logp
2.25298
H Acceptors
3
H Donors
0
Rotatable Bonds
2
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: C₁₂H₁₂N₂O
Molecular Weight: 200.24
Synonyms: None
SMILES: COC1=CC=C2N(C)C=C(CC#N)C2=C1
Tpsa: 37.95
Logp: 2.25298
H Acceptors: 3
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:
C₁₂H₁₂N₂O
Molecular Weight:
200.24
Synonyms:
None
SMILES:
COC1=CC=C2N(C)C=C(CC#N)C2=C1
Tpsa:
37.95
Logp:
2.25298
H Acceptors:
3
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: C₁₆H₁₃BrO₃
Molecular Weight: 333.18
Synonyms: None
SMILES: CC1=CC=C(C=C1)C(=O)C1=CC2=C(OCCO2)C=C1Br
Tpsa: 35.53
Logp: 3.75972
H Acceptors: 3
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:
C₁₆H₁₃BrO₃
Molecular Weight:
333.18
Synonyms:
None
SMILES:
CC1=CC=C(C=C1)C(=O)C1=CC2=C(OCCO2)C=C1Br
Tpsa:
35.53
Logp:
3.75972
H Acceptors:
3
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: C₁₅H₁₀BrNO₅
Molecular Weight: 364.15
Synonyms: None
SMILES: [O-][N+](=O)C1=CC=C(C=C1)C(=O)C1=CC2=C(OCCO2)C=C1Br
Tpsa: 78.67
Logp: 3.3595
H Acceptors: 5
H Donors: 0
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:
C₁₅H₁₀BrNO₅
Molecular Weight:
364.15
Synonyms:
None
SMILES:
[O-][N+](=O)C1=CC=C(C=C1)C(=O)C1=CC2=C(OCCO2)C=C1Br
Tpsa:
78.67
Logp:
3.3595
H Acceptors:
5
H Donors:
0
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: C₁₄H₁₂N₄O₄
Molecular Weight: 300.27
Synonyms: None
SMILES: C\C(=N/NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C1=CC=CC=C1
Tpsa: 110.67
Logp: 3.3391
H Acceptors: 6
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:
C₁₄H₁₂N₄O₄
Molecular Weight:
300.27
Synonyms:
None
SMILES:
C\C(=N/NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C1=CC=CC=C1
Tpsa:
110.67
Logp:
3.3391
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
5