CS-0579849
3-Methylisoquinoline-7-carboxylic acid
Manufacturer: ChemScene
CAS Number: 858646-62-5
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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
C₁₁H₉NO₂
Molecular Weight
187.19
Synonyms
3-Methyl-7-isoquinolinecarboxylic acid
SMILES
CC1=CC2=C(C=C(C=C2)C(=O)O)C=N1
Tpsa
50.19
Logp
2.24142
H Acceptors
2
H Donors
1
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₁₁H₉NO₂
Molecular Weight: 187.19
Synonyms: 3-Methyl-7-isoquinolinecarboxylic acid
SMILES: CC1=CC2=C(C=C(C=C2)C(=O)O)C=N1
Tpsa: 50.19
Logp: 2.24142
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:
C₁₁H₉NO₂
Molecular Weight:
187.19
Synonyms:
3-Methyl-7-isoquinolinecarboxylic acid
SMILES:
CC1=CC2=C(C=C(C=C2)C(=O)O)C=N1
Tpsa:
50.19
Logp:
2.24142
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: C₁₀H₇Cl₂NO
Molecular Weight: 228.07
Synonyms: None
SMILES: COC1=C(Cl)C=C2N=CC=C(Cl)C2=C1
Tpsa: 22.12
Logp: 3.5502
H Acceptors: 2
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:
C₁₀H₇Cl₂NO
Molecular Weight:
228.07
Synonyms:
None
SMILES:
COC1=C(Cl)C=C2N=CC=C(Cl)C2=C1
Tpsa:
22.12
Logp:
3.5502
H Acceptors:
2
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: C₆H₇F₂N₃O
Molecular Weight: 175.14
Synonyms: 2-Pyrimidinamine,4-(difluoromethoxy)-6-methyl
SMILES: CC1=CC(=NC(=N1)N)OC(F)F
Tpsa: 61.03
Logp: 0.96862
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:
C₆H₇F₂N₃O
Molecular Weight:
175.14
Synonyms:
2-Pyrimidinamine,4-(difluoromethoxy)-6-methyl
SMILES:
CC1=CC(=NC(=N1)N)OC(F)F
Tpsa:
61.03
Logp:
0.96862
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: C₁₅H₂₂O₂
Molecular Weight: 234.33
Synonyms: None
SMILES: CCC(=O)C1=C(C=CC(=C1)C)OCCC(C)C
Tpsa: 26.3
Logp: 4.01262
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₂O₂
Molecular Weight:
234.33
Synonyms:
None
SMILES:
CCC(=O)C1=C(C=CC(=C1)C)OCCC(C)C
Tpsa:
26.3
Logp:
4.01262
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
6