CS-0496998
Isopropyl 5,6-diaminonicotinate
Manufacturer: ChemScene
CAS Number: 403668-98-4
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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
C₉H₁₃N₃O₂
Molecular Weight
195.22
Synonyms
5,6-diamino-nicotinic acid isopropyl ester
SMILES
CC(C)OC(=O)C1C=C(N)C(N)=NC=1
Tpsa
91.23
Logp
0.8112
H Acceptors
5
H Donors
2
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 403668-98-4 | 3-Pyridinecarboxylicacid,5,6-diamino-,1-methylethylester(9CI) | A2B Chem | -- |
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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: C₉H₁₃N₃O₂
Molecular Weight: 195.22
Synonyms: 5,6-diamino-nicotinic acid isopropyl ester
SMILES: CC(C)OC(=O)C1C=C(N)C(N)=NC=1
Tpsa: 91.23
Logp: 0.8112
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:
C₉H₁₃N₃O₂
Molecular Weight:
195.22
Synonyms:
5,6-diamino-nicotinic acid isopropyl ester
SMILES:
CC(C)OC(=O)C1C=C(N)C(N)=NC=1
Tpsa:
91.23
Logp:
0.8112
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD09030031
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₄Cl₂N₂O₂
Molecular Weight: 231.04
Synonyms: 2,6-DICHLORO-4-NITROBENZENEACETONITRILE
SMILES: N#CCC1=C(Cl)C=C([N+](=O)[O-])C=C1Cl
Tpsa: 66.93
Logp: 2.96768
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD09030031
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄Cl₂N₂O₂
Molecular Weight:
231.04
Synonyms:
2,6-DICHLORO-4-NITROBENZENEACETONITRILE
SMILES:
N#CCC1=C(Cl)C=C([N+](=O)[O-])C=C1Cl
Tpsa:
66.93
Logp:
2.96768
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 96%
MDL No: MFCD17171361
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₈N₂O₃
Molecular Weight: 392.49
Synonyms: VX-770
SMILES: CC(C)(C1=C(C=C(C(C(C)(C)C)=C1)O)NC(C2=CNC3=C(C2=O)C=CC=C3)=O)C
Tpsa: 82.19
Logp: 5.081
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 2
Purity:
96%
MDL No:
MFCD17171361
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₈N₂O₃
Molecular Weight:
392.49
Synonyms:
VX-770
SMILES:
CC(C)(C1=C(C=C(C(C(C)(C)C)=C1)O)NC(C2=CNC3=C(C2=O)C=CC=C3)=O)C
Tpsa:
82.19
Logp:
5.081
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD28790808
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₄F₂N₂O₂
Molecular Weight: 198.13
Synonyms: 2,6-Difluoro-4-nitrophenylacetonitrile
SMILES: N#CCC1=C(F)C=C([N+](=O)[O-])C=C1F
Tpsa: 66.93
Logp: 1.93908
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28790808
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄F₂N₂O₂
Molecular Weight:
198.13
Synonyms:
2,6-Difluoro-4-nitrophenylacetonitrile
SMILES:
N#CCC1=C(F)C=C([N+](=O)[O-])C=C1F
Tpsa:
66.93
Logp:
1.93908
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2