CS-0594239
3-(2,6,6-Trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 1022580-03-5
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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
C₁₈H₁₈N₂O
Molecular Weight
278.35
Synonyms
None
SMILES
CC1=CC2=C(N1C3=CC=CC(=C3)C#N)CC(CC2=O)(C)C
Tpsa
45.79
Logp
3.8125
H Acceptors
3
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1022580-03-5 | 3-(2,6,6-Trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl)benzonitrile | A2B Chem | -- |
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: C₁₈H₁₈N₂O
Molecular Weight: 278.35
Synonyms: None
SMILES: CC1=CC2=C(N1C3=CC=CC(=C3)C#N)CC(CC2=O)(C)C
Tpsa: 45.79
Logp: 3.8125
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:
C₁₈H₁₈N₂O
Molecular Weight:
278.35
Synonyms:
None
SMILES:
CC1=CC2=C(N1C3=CC=CC(=C3)C#N)CC(CC2=O)(C)C
Tpsa:
45.79
Logp:
3.8125
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD00830464
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇NO₂
Molecular Weight: 231.29
Synonyms: None
SMILES: CCCCC1=C(C2=CC=CC=C2N(C1=O)C)O
Tpsa: 42.23
Logp: 2.5867
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD00830464
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇NO₂
Molecular Weight:
231.29
Synonyms:
None
SMILES:
CCCCC1=C(C2=CC=CC=C2N(C1=O)C)O
Tpsa:
42.23
Logp:
2.5867
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: C₁₀H₈FN₃O
Molecular Weight: 205.19
Synonyms: None
SMILES: C1=CC=C(C(=C1)C2=CC(=O)NC(=N2)N)F
Tpsa: 71.77
Logp: 1.1582
H Acceptors: 3
H Donors: 2
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:
C₁₀H₈FN₃O
Molecular Weight:
205.19
Synonyms:
None
SMILES:
C1=CC=C(C(=C1)C2=CC(=O)NC(=N2)N)F
Tpsa:
71.77
Logp:
1.1582
H Acceptors:
3
H Donors:
2
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: C₈H₁₂ClN₃O
Molecular Weight: 201.65
Synonyms: None
SMILES: CC(COC)NC1=NN=C(C=C1)Cl
Tpsa: 47.04
Logp: 1.5768
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₂ClN₃O
Molecular Weight:
201.65
Synonyms:
None
SMILES:
CC(COC)NC1=NN=C(C=C1)Cl
Tpsa:
47.04
Logp:
1.5768
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4