CS-0763993
2-Benzyl-5-Hydroxyisoquinolin-2-ium chloride
Manufacturer: ChemScene
CAS Number: 438564-81-9
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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
C₁₆H₁₄ClNO
Molecular Weight
271.74
Synonyms
None
SMILES
[Cl-].OC1=C2C=C[N+](CC3=CC=CC=C3)=CC2=CC=C1
Tpsa
24.11
Logp
-0.1148
H Acceptors
1
H Donors
1
Rotatable Bonds
2
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: C₁₆H₁₄ClNO
Molecular Weight: 271.74
Synonyms: None
SMILES: [Cl-].OC1=C2C=C[N+](CC3=CC=CC=C3)=CC2=CC=C1
Tpsa: 24.11
Logp: -0.1148
H Acceptors: 1
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:
C₁₆H₁₄ClNO
Molecular Weight:
271.74
Synonyms:
None
SMILES:
[Cl-].OC1=C2C=C[N+](CC3=CC=CC=C3)=CC2=CC=C1
Tpsa:
24.11
Logp:
-0.1148
H Acceptors:
1
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: C₁₁H₁₄Cl₂N₄
Molecular Weight: 273.16
Synonyms: None
SMILES: Cl.[Cl-].CC1=NC=C(C[N+]2=CC=CC=C2)C(N)=N1
Tpsa: 55.68
Logp: -1.87118
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:
C₁₁H₁₄Cl₂N₄
Molecular Weight:
273.16
Synonyms:
None
SMILES:
Cl.[Cl-].CC1=NC=C(C[N+]2=CC=CC=C2)C(N)=N1
Tpsa:
55.68
Logp:
-1.87118
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: C₁₇H₁₁N₃O
Molecular Weight: 273.29
Synonyms: None
SMILES: O=C(N1N=NC2=CC=CC=C12)C1=CC2=CC=CC=C2C=C1
Tpsa: 47.78
Logp: 3.273
H Acceptors: 4
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:
C₁₇H₁₁N₃O
Molecular Weight:
273.29
Synonyms:
None
SMILES:
O=C(N1N=NC2=CC=CC=C12)C1=CC2=CC=CC=C2C=C1
Tpsa:
47.78
Logp:
3.273
H Acceptors:
4
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: C₁₃H₁₁N₃O₂S
Molecular Weight: 273.31
Synonyms: None
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N1N=NC2=CC=CC=C12
Tpsa: 64.85
Logp: 1.97672
H Acceptors: 5
H Donors: 0
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:
C₁₃H₁₁N₃O₂S
Molecular Weight:
273.31
Synonyms:
None
SMILES:
CC1=CC=C(C=C1)S(=O)(=O)N1N=NC2=CC=CC=C12
Tpsa:
64.85
Logp:
1.97672
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2