CS-0540943
Methyl 2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-6-carboxylate
Manufacturer: ChemScene
CAS Number: 643087-28-9
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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
C₁₂H₁₃NO₃
Molecular Weight
219.24
Synonyms
6-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-methyl-1-oxo-, methyl ester
SMILES
CN1CCC2=C(C1=O)C=CC(=C2)C(=O)OC
Tpsa
46.61
Logp
1.1013
H Acceptors
3
H Donors
0
Rotatable Bonds
1
Related Products
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: C₁₂H₁₃NO₃
Molecular Weight: 219.24
Synonyms: 6-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-methyl-1-oxo-, methyl ester
SMILES: CN1CCC2=C(C1=O)C=CC(=C2)C(=O)OC
Tpsa: 46.61
Logp: 1.1013
H Acceptors: 3
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:
C₁₂H₁₃NO₃
Molecular Weight:
219.24
Synonyms:
6-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-methyl-1-oxo-, methyl ester
SMILES:
CN1CCC2=C(C1=O)C=CC(=C2)C(=O)OC
Tpsa:
46.61
Logp:
1.1013
H Acceptors:
3
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: C₄H₄N₂O₂
Molecular Weight: 112.09
Synonyms: 1-Hydroxypyrazin-2-one
SMILES: C1=CN(C(=O)C=N1)O
Tpsa: 55.12
Logp: -0.5194
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₄N₂O₂
Molecular Weight:
112.09
Synonyms:
1-Hydroxypyrazin-2-one
SMILES:
C1=CN(C(=O)C=N1)O
Tpsa:
55.12
Logp:
-0.5194
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀N₂O₃S
Molecular Weight: 214.24
Synonyms: None
SMILES: CN=S(C1=CC=C([N+]([O-])=O)C=C1)(C)=O
Tpsa: 72.57
Logp: 1.6813
H Acceptors: 4
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:
C₈H₁₀N₂O₃S
Molecular Weight:
214.24
Synonyms:
None
SMILES:
CN=S(C1=CC=C([N+]([O-])=O)C=C1)(C)=O
Tpsa:
72.57
Logp:
1.6813
H Acceptors:
4
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: C₁₄H₁₉BO₄S
Molecular Weight: 294.17
Synonyms: Benzo[c]thiophene, 1,3-dihydro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 2,2-dioxide
SMILES: CC1(C)C(C)(C)OB(C2=CC=C(C(C3)=C2)CS3(=O)=O)O1
Tpsa: 52.6
Logp: 1.4142
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:
C₁₄H₁₉BO₄S
Molecular Weight:
294.17
Synonyms:
Benzo[c]thiophene, 1,3-dihydro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 2,2-dioxide
SMILES:
CC1(C)C(C)(C)OB(C2=CC=C(C(C3)=C2)CS3(=O)=O)O1
Tpsa:
52.6
Logp:
1.4142
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1