CS-0733292
Methyl 5-cyano-6-isopropoxynicotinate
Manufacturer: ChemScene
CAS Number: 1312008-56-2
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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
C₁₁H₁₂N₂O₃
Molecular Weight
220.22
Synonyms
None
SMILES
COC(=O)C1=CN=C(OC(C)C)C(=C1)C#N
Tpsa
72.21
Logp
1.52708
H Acceptors
5
H Donors
0
Rotatable Bonds
3
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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: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂N₂O₃
Molecular Weight: 220.22
Synonyms: None
SMILES: COC(=O)C1=CN=C(OC(C)C)C(=C1)C#N
Tpsa: 72.21
Logp: 1.52708
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂N₂O₃
Molecular Weight:
220.22
Synonyms:
None
SMILES:
COC(=O)C1=CN=C(OC(C)C)C(=C1)C#N
Tpsa:
72.21
Logp:
1.52708
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁N₃
Molecular Weight: 173.21
Synonyms: None
SMILES: C=CCNC1=C2C=CNC2=NC=C1
Tpsa: 40.71
Logp: 2.1608
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁N₃
Molecular Weight:
173.21
Synonyms:
None
SMILES:
C=CCNC1=C2C=CNC2=NC=C1
Tpsa:
40.71
Logp:
2.1608
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈N₄
Molecular Weight: 148.17
Synonyms: None
SMILES: NCC1=NN2C=CC=CC2=N1
Tpsa: 56.21
Logp: 0.188
H Acceptors: 4
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:
C₇H₈N₄
Molecular Weight:
148.17
Synonyms:
None
SMILES:
NCC1=NN2C=CC=CC2=N1
Tpsa:
56.21
Logp:
0.188
H Acceptors:
4
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: C₁₃H₈ClF₂NO
Molecular Weight: 267.66
Synonyms: None
SMILES: NC1=C(C=C(F)C(F)=C1)C(=O)C1=C(Cl)C=CC=C1
Tpsa: 43.09
Logp: 3.4314
H Acceptors: 2
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:
C₁₃H₈ClF₂NO
Molecular Weight:
267.66
Synonyms:
None
SMILES:
NC1=C(C=C(F)C(F)=C1)C(=O)C1=C(Cl)C=CC=C1
Tpsa:
43.09
Logp:
3.4314
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2