CS-0754387
1-Benzyl-3-((methoxycarbonyl)amino)-4-methylpyridin-1-ium bromide
Manufacturer: ChemScene
CAS Number: 923036-27-5
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₅H₁₇BrN₂O₂
Molecular Weight
337.21
Synonyms
None
SMILES
[Br-].COC(=O)NC1=C(C)C=C[N+](CC2=CC=CC=C2)=C1
Tpsa
42.21
Logp
-0.48688
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₇BrN₂O₂
Molecular Weight: 337.21
Synonyms: None
SMILES: [Br-].COC(=O)NC1=C(C)C=C[N+](CC2=CC=CC=C2)=C1
Tpsa: 42.21
Logp: -0.48688
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₇BrN₂O₂
Molecular Weight:
337.21
Synonyms:
None
SMILES:
[Br-].COC(=O)NC1=C(C)C=C[N+](CC2=CC=CC=C2)=C1
Tpsa:
42.21
Logp:
-0.48688
H Acceptors:
2
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: C₈H₉N₃O₃
Molecular Weight: 195.18
Synonyms: None
SMILES: CN(C)C(=O)C1=C(N=CC=N1)C(O)=O
Tpsa: 83.39
Logp: -0.1234
H Acceptors: 4
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:
C₈H₉N₃O₃
Molecular Weight:
195.18
Synonyms:
None
SMILES:
CN(C)C(=O)C1=C(N=CC=N1)C(O)=O
Tpsa:
83.39
Logp:
-0.1234
H Acceptors:
4
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: C₇H₇N₃O₃
Molecular Weight: 181.15
Synonyms: None
SMILES: CNC(=O)C1=NC=CN=C1C(O)=O
Tpsa: 92.18
Logp: -0.4656
H Acceptors: 4
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:
C₇H₇N₃O₃
Molecular Weight:
181.15
Synonyms:
None
SMILES:
CNC(=O)C1=NC=CN=C1C(O)=O
Tpsa:
92.18
Logp:
-0.4656
H Acceptors:
4
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: C₇H₆N₂O₄
Molecular Weight: 182.13
Synonyms: None
SMILES: COC(=O)C1=NC(=CN=C1)C(O)=O
Tpsa: 89.38
Logp: -0.0386
H Acceptors: 5
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:
C₇H₆N₂O₄
Molecular Weight:
182.13
Synonyms:
None
SMILES:
COC(=O)C1=NC(=CN=C1)C(O)=O
Tpsa:
89.38
Logp:
-0.0386
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2