CS-0998738
Methyl 4-cyano-1-(1-methylcyclopropyl)-6-oxo-1,6-dihydropyridine-3-carboxylate
Manufacturer: ChemScene
CAS Number: 3025766-10-0
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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
C₁₂H₁₂N₂O₃
Molecular Weight
232.24
Synonyms
None
SMILES
N#CC1=CC(=O)N(C=C1C(=O)OC)C2(C)CC2
Tpsa
72.09
Logp
1.01558
H Acceptors
5
H Donors
0
Rotatable Bonds
2
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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
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: C₁₂H₁₂N₂O₃
Molecular Weight: 232.24
Synonyms: None
SMILES: N#CC1=CC(=O)N(C=C1C(=O)OC)C2(C)CC2
Tpsa: 72.09
Logp: 1.01558
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:
C₁₂H₁₂N₂O₃
Molecular Weight:
232.24
Synonyms:
None
SMILES:
N#CC1=CC(=O)N(C=C1C(=O)OC)C2(C)CC2
Tpsa:
72.09
Logp:
1.01558
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₂F₃N₃O
Molecular Weight: 165.07
Synonyms: None
SMILES: O=CC1=NN=C(N1)C(F)(F)F
Tpsa: 58.64
Logp: 0.636
H Acceptors: 3
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:
C₄H₂F₃N₃O
Molecular Weight:
165.07
Synonyms:
None
SMILES:
O=CC1=NN=C(N1)C(F)(F)F
Tpsa:
58.64
Logp:
0.636
H Acceptors:
3
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: C₄H₄F₃N₃O
Molecular Weight: 167.09
Synonyms: None
SMILES: FC(F)(F)C1=NN=C(N1)CO
Tpsa: 61.8
Logp: 0.3158
H Acceptors: 3
H Donors: 2
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:
C₄H₄F₃N₃O
Molecular Weight:
167.09
Synonyms:
None
SMILES:
FC(F)(F)C1=NN=C(N1)CO
Tpsa:
61.8
Logp:
0.3158
H Acceptors:
3
H Donors:
2
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: C₁₁H₁₀BrN₃O
Molecular Weight: 280.12
Synonyms: None
SMILES: O=C1C=C2C(=CN1C3CC3)C(Br)=NN=C2C
Tpsa: 47.78
Logp: 2.19732
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:
C₁₁H₁₀BrN₃O
Molecular Weight:
280.12
Synonyms:
None
SMILES:
O=C1C=C2C(=CN1C3CC3)C(Br)=NN=C2C
Tpsa:
47.78
Logp:
2.19732
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1