CS-0326980
N-(3-cyano-4,5-dimethylthiophen-2-yl)isobutyramide
Manufacturer: ChemScene
CAS Number: 560078-63-9
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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
C₁₁H₁₄N₂OS
Molecular Weight
222.31
Synonyms
None
SMILES
CC(C(NC1=C(C(C)=C(S1)C)C#N)=O)C
Tpsa
52.89
Logp
2.83112
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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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: C₁₁H₁₄N₂OS
Molecular Weight: 222.31
Synonyms: None
SMILES: CC(C(NC1=C(C(C)=C(S1)C)C#N)=O)C
Tpsa: 52.89
Logp: 2.83112
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:
C₁₁H₁₄N₂OS
Molecular Weight:
222.31
Synonyms:
None
SMILES:
CC(C(NC1=C(C(C)=C(S1)C)C#N)=O)C
Tpsa:
52.89
Logp:
2.83112
H Acceptors:
3
H Donors:
1
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: C₁₃H₁₈N₂O₂
Molecular Weight: 234.29
Synonyms: 3-[(3,4-Dimethoxyphenethyl)Amino]Propanenitrile
SMILES: COC1=C(C=C(C=C1)CCNCCC#N)OC
Tpsa: 54.28
Logp: 1.74958
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 7
Purity:
95+%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₈N₂O₂
Molecular Weight:
234.29
Synonyms:
3-[(3,4-Dimethoxyphenethyl)Amino]Propanenitrile
SMILES:
COC1=C(C=C(C=C1)CCNCCC#N)OC
Tpsa:
54.28
Logp:
1.74958
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₉ClN₂O₄S
Molecular Weight: 312.73
Synonyms: None
SMILES: C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C(=C2)[N+](=O)[O-])Cl
Tpsa: 89.31
Logp: 3.049
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:
C₁₂H₉ClN₂O₄S
Molecular Weight:
312.73
Synonyms:
None
SMILES:
C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C(=C2)[N+](=O)[O-])Cl
Tpsa:
89.31
Logp:
3.049
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: C₇H₁₀N₂O₂
Molecular Weight: 154.17
Synonyms: 1H-Imidazole-2-carboxaldehyde, 1-(2-methoxyethyl)- (9CI)
SMILES: COCCN1C=CN=C1C=O
Tpsa: 44.12
Logp: 0.342
H Acceptors: 4
H Donors: 0
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:
C₇H₁₀N₂O₂
Molecular Weight:
154.17
Synonyms:
1H-Imidazole-2-carboxaldehyde, 1-(2-methoxyethyl)- (9CI)
SMILES:
COCCN1C=CN=C1C=O
Tpsa:
44.12
Logp:
0.342
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4