CS-0623746
tert-Butyl 6-cyano-1,3-dihydro-2H-pyrrolo[3,4-c]pyridine-2-carboxylate
Manufacturer: ChemScene
CAS Number: 1823557-01-2
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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
C₁₃H₁₅N₃O₂
Molecular Weight
245.28
Synonyms
None
SMILES
O=C(N(C1)CC2=C1C=C(C#N)N=C2)OC(C)(C)C
Tpsa
66.22
Logp
2.20398
H Acceptors
4
H Donors
0
Rotatable Bonds
0
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: C₁₃H₁₅N₃O₂
Molecular Weight: 245.28
Synonyms: None
SMILES: O=C(N(C1)CC2=C1C=C(C#N)N=C2)OC(C)(C)C
Tpsa: 66.22
Logp: 2.20398
H Acceptors: 4
H Donors: 0
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:
C₁₃H₁₅N₃O₂
Molecular Weight:
245.28
Synonyms:
None
SMILES:
O=C(N(C1)CC2=C1C=C(C#N)N=C2)OC(C)(C)C
Tpsa:
66.22
Logp:
2.20398
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: -20°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₃ClN₂O₄S
Molecular Weight: 340.78
Synonyms: None
SMILES: O=C(NC1=NC=C(C)C=C1S(=O)(Cl)=O)OCC2=CC=CC=C2
Tpsa: 85.36
Logp: 3.06622
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
-20°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₃ClN₂O₄S
Molecular Weight:
340.78
Synonyms:
None
SMILES:
O=C(NC1=NC=C(C)C=C1S(=O)(Cl)=O)OCC2=CC=CC=C2
Tpsa:
85.36
Logp:
3.06622
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂N₄
Molecular Weight: 236.27
Synonyms: None
SMILES: N#CC1=NN=C(CN(CC2=CC=CC=C2)C3)C3=C1
Tpsa: 52.81
Logp: 1.86408
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:
C₁₄H₁₂N₄
Molecular Weight:
236.27
Synonyms:
None
SMILES:
N#CC1=NN=C(CN(CC2=CC=CC=C2)C3)C3=C1
Tpsa:
52.81
Logp:
1.86408
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: C₁₂H₁₄N₄O₂
Molecular Weight: 246.27
Synonyms: None
SMILES: O=C(N1CC2=NC(C#N)=NC=C2C1)OC(C)(C)C
Tpsa: 79.11
Logp: 1.59898
H Acceptors: 5
H Donors: 0
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:
C₁₂H₁₄N₄O₂
Molecular Weight:
246.27
Synonyms:
None
SMILES:
O=C(N1CC2=NC(C#N)=NC=C2C1)OC(C)(C)C
Tpsa:
79.11
Logp:
1.59898
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
0