CS-0901847
3-Methylisoquinoline-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1337880-02-0
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Purity
98%
MDL No
MFCD22380209
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₉NO₂
Molecular Weight
187.19
Synonyms
None
SMILES
O=C(O)C1=CC=CC2=CN=C(C=C21)C
Tpsa
50.19
Logp
2.24142
H Acceptors
2
H Donors
1
Rotatable Bonds
1
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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
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Purity: 98%
MDL No: MFCD22380209
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₉NO₂
Molecular Weight: 187.19
Synonyms: None
SMILES: O=C(O)C1=CC=CC2=CN=C(C=C21)C
Tpsa: 50.19
Logp: 2.24142
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD22380209
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₉NO₂
Molecular Weight:
187.19
Synonyms:
None
SMILES:
O=C(O)C1=CC=CC2=CN=C(C=C21)C
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: C₁₃H₁₄N₂O₂
Molecular Weight: 230.26
Synonyms: None
SMILES: O=CC=1C=CC=2C=NN(C2C1)C3OCCCC3
Tpsa: 44.12
Logp: 2.5479
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:
C₁₃H₁₄N₂O₂
Molecular Weight:
230.26
Synonyms:
None
SMILES:
O=CC=1C=CC=2C=NN(C2C1)C3OCCCC3
Tpsa:
44.12
Logp:
2.5479
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD19443357
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₃N₃O₃
Molecular Weight: 247.25
Synonyms: None
SMILES: O=N(=O)C1=CC=CC=2C=NN(C21)C3OCCCC3
Tpsa: 70.19
Logp: 2.6436
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD19443357
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃N₃O₃
Molecular Weight:
247.25
Synonyms:
None
SMILES:
O=N(=O)C1=CC=CC=2C=NN(C21)C3OCCCC3
Tpsa:
70.19
Logp:
2.6436
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: C₈H₅ClN₂O
Molecular Weight: 180.59
Synonyms: None
SMILES: O=CC1=CC=CC=2C(Cl)=NNC12
Tpsa: 45.75
Logp: 2.0288
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:
C₈H₅ClN₂O
Molecular Weight:
180.59
Synonyms:
None
SMILES:
O=CC1=CC=CC=2C(Cl)=NNC12
Tpsa:
45.75
Logp:
2.0288
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1