CS-0490879
Methyl 1-(2-chlorophenyl)isoquinoline-3-carboxylate
Manufacturer: ChemScene
CAS Number: 439614-63-8
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Purity
98%
MDL No
MFCD17214996
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₇H₁₂ClNO₂
Molecular Weight
297.74
Synonyms
1-(2-chlorophenyl)isoquinoline-3-carboxylic acid methyl ester
SMILES
COC(=O)C1N=C(C2=C(Cl)C=CC=C2)C3C(=CC=CC=3)C=1
Tpsa
39.19
Logp
4.3418
H Acceptors
3
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 439614-63-8 | 3-Isoquinolinecarboxylic acid, 1-(2-chlorophenyl)-, methyl ester | 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
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: MFCD17214996
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₂ClNO₂
Molecular Weight: 297.74
Synonyms: 1-(2-chlorophenyl)isoquinoline-3-carboxylic acid methyl ester
SMILES: COC(=O)C1N=C(C2=C(Cl)C=CC=C2)C3C(=CC=CC=3)C=1
Tpsa: 39.19
Logp: 4.3418
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD17214996
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₂ClNO₂
Molecular Weight:
297.74
Synonyms:
1-(2-chlorophenyl)isoquinoline-3-carboxylic acid methyl ester
SMILES:
COC(=O)C1N=C(C2=C(Cl)C=CC=C2)C3C(=CC=CC=3)C=1
Tpsa:
39.19
Logp:
4.3418
H Acceptors:
3
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: C₁₁H₈BrNO₂
Molecular Weight: 266.09
Synonyms: Methyl 1-bromo-3-isoquinolinecarboxylate
SMILES: COC(=O)C1=CC2C(=CC=CC=2)C(Br)=N1
Tpsa: 39.19
Logp: 2.7839
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₈BrNO₂
Molecular Weight:
266.09
Synonyms:
Methyl 1-bromo-3-isoquinolinecarboxylate
SMILES:
COC(=O)C1=CC2C(=CC=CC=2)C(Br)=N1
Tpsa:
39.19
Logp:
2.7839
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD30752095
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₆BrNO₂
Molecular Weight: 252.06
Synonyms: None
SMILES: OC(=O)C1=CC2C(=CC=CC=2)C(Br)=N1
Tpsa: 50.19
Logp: 2.6955
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD30752095
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₆BrNO₂
Molecular Weight:
252.06
Synonyms:
None
SMILES:
OC(=O)C1=CC2C(=CC=CC=2)C(Br)=N1
Tpsa:
50.19
Logp:
2.6955
H Acceptors:
2
H Donors:
1
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: C₁₁H₈BrNO₃
Molecular Weight: 282.09
Synonyms: None
SMILES: COC1=C2C(=CC=C1)C(Br)=NC(C(O)=O)=C2
Tpsa: 59.42
Logp: 2.7041
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:
C₁₁H₈BrNO₃
Molecular Weight:
282.09
Synonyms:
None
SMILES:
COC1=C2C(=CC=C1)C(Br)=NC(C(O)=O)=C2
Tpsa:
59.42
Logp:
2.7041
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2