CS-0580789
3,4-Dimethyl-5-nitrobenzonitrile
Manufacturer: ChemScene
CAS Number: 52911-61-2
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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
C₉H₈N₂O₂
Molecular Weight
176.17
Synonyms
None
SMILES
CC1=CC(=CC(=C1C)[N+](=O)[O-])C#N
Tpsa
66.93
Logp
2.08332
H Acceptors
3
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 52911-61-2 | 3,4-Dimethyl-5-nitrobenzonitrile | 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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈N₂O₂
Molecular Weight: 176.17
Synonyms: None
SMILES: CC1=CC(=CC(=C1C)[N+](=O)[O-])C#N
Tpsa: 66.93
Logp: 2.08332
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:
C₉H₈N₂O₂
Molecular Weight:
176.17
Synonyms:
None
SMILES:
CC1=CC(=CC(=C1C)[N+](=O)[O-])C#N
Tpsa:
66.93
Logp:
2.08332
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: C₈H₁₁N
Molecular Weight: 121.18
Synonyms: BETA-COLLIDINE
SMILES: CCC1=C(C=CN=C1)C
Tpsa: 12.89
Logp: 1.95242
H Acceptors: 1
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:
C₈H₁₁N
Molecular Weight:
121.18
Synonyms:
BETA-COLLIDINE
SMILES:
CCC1=C(C=CN=C1)C
Tpsa:
12.89
Logp:
1.95242
H Acceptors:
1
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: C₁₄H₁₃NO₃
Molecular Weight: 243.26
Synonyms: 2-amino-4-phenylmethoxybenzoic acid
SMILES: C1=CC=C(C=C1)COC2=CC(=C(C=C2)C(=O)O)N
Tpsa: 72.55
Logp: 2.546
H Acceptors: 3
H Donors: 2
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:
C₁₄H₁₃NO₃
Molecular Weight:
243.26
Synonyms:
2-amino-4-phenylmethoxybenzoic acid
SMILES:
C1=CC=C(C=C1)COC2=CC(=C(C=C2)C(=O)O)N
Tpsa:
72.55
Logp:
2.546
H Acceptors:
3
H Donors:
2
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: C₅H₇N₃OS₂
Molecular Weight: 189.26
Synonyms: 5-Amino-2-(methylthio)-1,3-thiazole-4-carboxamide
SMILES: CSC1=NC(=C(S1)N)C(=O)N
Tpsa: 82
Logp: 0.5461
H Acceptors: 5
H Donors: 2
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:
C₅H₇N₃OS₂
Molecular Weight:
189.26
Synonyms:
5-Amino-2-(methylthio)-1,3-thiazole-4-carboxamide
SMILES:
CSC1=NC(=C(S1)N)C(=O)N
Tpsa:
82
Logp:
0.5461
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2