CS-0754087
3-Oxo-2,3-dihydroisoquinoline-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1337879-89-6
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₀H₇NO₃
Molecular Weight
189.17
Synonyms
None
SMILES
OC(=O)C1=CC=CC2=CNC(=O)C=C12
Tpsa
70.16
Logp
1.2263
H Acceptors
2
H Donors
2
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₇NO₃
Molecular Weight: 189.17
Synonyms: None
SMILES: OC(=O)C1=CC=CC2=CNC(=O)C=C12
Tpsa: 70.16
Logp: 1.2263
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇NO₃
Molecular Weight:
189.17
Synonyms:
None
SMILES:
OC(=O)C1=CC=CC2=CNC(=O)C=C12
Tpsa:
70.16
Logp:
1.2263
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅BrF₃N₃
Molecular Weight: 280.04
Synonyms: None
SMILES: CC1=CC(Br)=CN2N=C(N=C12)C(F)(F)F
Tpsa: 30.19
Logp: 2.81902
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅BrF₃N₃
Molecular Weight:
280.04
Synonyms:
None
SMILES:
CC1=CC(Br)=CN2N=C(N=C12)C(F)(F)F
Tpsa:
30.19
Logp:
2.81902
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₈N₄
Molecular Weight: 112.13
Synonyms: None
SMILES: CN1C(C)=NN=C1N
Tpsa: 56.73
Logp: -0.29428
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₈N₄
Molecular Weight:
112.13
Synonyms:
None
SMILES:
CN1C(C)=NN=C1N
Tpsa:
56.73
Logp:
-0.29428
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₁IN₄
Molecular Weight: 266.08
Synonyms: None
SMILES: I.CN1C(N)=NN=C1C1CC1
Tpsa: 56.73
Logp: 0.8927
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₁IN₄
Molecular Weight:
266.08
Synonyms:
None
SMILES:
I.CN1C(N)=NN=C1C1CC1
Tpsa:
56.73
Logp:
0.8927
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1