CS-0379364
2-((Isonicotinoyloxy)methyl)-2-methylpropane-1,3-diyl diisonicotinate
Manufacturer: ChemScene
CAS Number: 1416894-12-6
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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
C₂₃H₂₁N₃O₆
Molecular Weight
435.43
Synonyms
4-Pyridinecarboxylic acid, 4,4'-[2-methyl-2-[[(4-pyridinylcarbonyl)oxy]methyl]-1,3-propanediyl] ester
SMILES
O=C(C1=CC=NC=C1)OCC(COC(C2=CC=NC=C2)=O)(COC(C3=CC=NC=C3)=O)C
Tpsa
117.57
Logp
2.7487
H Acceptors
9
H Donors
0
Rotatable Bonds
9
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: C₂₃H₂₁N₃O₆
Molecular Weight: 435.43
Synonyms: 4-Pyridinecarboxylic acid, 4,4'-[2-methyl-2-[[(4-pyridinylcarbonyl)oxy]methyl]-1,3-propanediyl] ester
SMILES: O=C(C1=CC=NC=C1)OCC(COC(C2=CC=NC=C2)=O)(COC(C3=CC=NC=C3)=O)C
Tpsa: 117.57
Logp: 2.7487
H Acceptors: 9
H Donors: 0
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₁N₃O₆
Molecular Weight:
435.43
Synonyms:
4-Pyridinecarboxylic acid, 4,4'-[2-methyl-2-[[(4-pyridinylcarbonyl)oxy]methyl]-1,3-propanediyl] ester
SMILES:
O=C(C1=CC=NC=C1)OCC(COC(C2=CC=NC=C2)=O)(COC(C3=CC=NC=C3)=O)C
Tpsa:
117.57
Logp:
2.7487
H Acceptors:
9
H Donors:
0
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Store at room temperature, keep dry and cool
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₇ClN₄
Molecular Weight: 358.91
Synonyms: (2S,2'S)-[N,N'-Bis(2-pyridylmethyl)]-2,2'-bipyrrolidine tetrahydrochloride
SMILES: [H][C@@]1(N(CCC1)CC2=CC=CC=N2)[C@@](CCC3)([H])N3CC4=CC=CC=N4.Cl
Tpsa: 32.26
Logp: 3.5274
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Store at room temperature, keep dry and cool
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₇ClN₄
Molecular Weight:
358.91
Synonyms:
(2S,2'S)-[N,N'-Bis(2-pyridylmethyl)]-2,2'-bipyrrolidine tetrahydrochloride
SMILES:
[H][C@@]1(N(CCC1)CC2=CC=CC=N2)[C@@](CCC3)([H])N3CC4=CC=CC=N4.Cl
Tpsa:
32.26
Logp:
3.5274
H Acceptors:
4
H Donors:
0
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: C₁₈H₁₄N₆
Molecular Weight: 314.34
Synonyms: None
SMILES: C1(CN2N=C(C3=CC=NC=C3)N=C2C4=CC=NC=C4)=CC=CN=C1
Tpsa: 69.38
Logp: 2.8454
H Acceptors: 6
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:
C₁₈H₁₄N₆
Molecular Weight:
314.34
Synonyms:
None
SMILES:
C1(CN2N=C(C3=CC=NC=C3)N=C2C4=CC=NC=C4)=CC=CN=C1
Tpsa:
69.38
Logp:
2.8454
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁BrO
Molecular Weight: 227.10
Synonyms: α-Bromoisobutyrophenone
SMILES: O=C(C(C)(C)Br)C1=CC=CC=C1
Tpsa: 17.07
Logp: 3.0428
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁BrO
Molecular Weight:
227.10
Synonyms:
α-Bromoisobutyrophenone
SMILES:
O=C(C(C)(C)Br)C1=CC=CC=C1
Tpsa:
17.07
Logp:
3.0428
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2