CS-0880478
2-Cyano-4-methylnicotinic acid
Manufacturer: ChemScene
CAS Number: 1541653-60-4
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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
C₈H₆N₂O₂
Molecular Weight
162.15
Synonyms
None
SMILES
O=C(C1=C(C)C=CN=C1C#N)O
Tpsa
73.98
Logp
0.9599
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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: C₈H₆N₂O₂
Molecular Weight: 162.15
Synonyms: None
SMILES: O=C(C1=C(C)C=CN=C1C#N)O
Tpsa: 73.98
Logp: 0.9599
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:
C₈H₆N₂O₂
Molecular Weight:
162.15
Synonyms:
None
SMILES:
O=C(C1=C(C)C=CN=C1C#N)O
Tpsa:
73.98
Logp:
0.9599
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: C₁₁H₉NO₂
Molecular Weight: 187.19
Synonyms: None
SMILES: O=C(C1=CC=C2C(C)=CC=NC2=C1)O
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:
C₁₁H₉NO₂
Molecular Weight:
187.19
Synonyms:
None
SMILES:
O=C(C1=CC=C2C(C)=CC=NC2=C1)O
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: C₂₇H₂₇F₂N₅O₃S
Molecular Weight: 539.60
Synonyms: None
SMILES: O=C(C1=C(F)C(NS(=O)(CCC)=O)=CC=C1F)C2=CNC3=NC=C(C4=CC=C(N5CCNCC5)C=C4)C=C32
Tpsa: 107.19
Logp: 4.3004
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₂₇F₂N₅O₃S
Molecular Weight:
539.60
Synonyms:
None
SMILES:
O=C(C1=C(F)C(NS(=O)(CCC)=O)=CC=C1F)C2=CNC3=NC=C(C4=CC=C(N5CCNCC5)C=C4)C=C32
Tpsa:
107.19
Logp:
4.3004
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈N₂O₃
Molecular Weight: 192.17
Synonyms: None
SMILES: O=C(C1=C(C)C=C(N2)C(NC2=O)=C1)O
Tpsa: 85.95
Logp: 0.86282
H Acceptors: 2
H Donors: 3
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:
C₉H₈N₂O₃
Molecular Weight:
192.17
Synonyms:
None
SMILES:
O=C(C1=C(C)C=C(N2)C(NC2=O)=C1)O
Tpsa:
85.95
Logp:
0.86282
H Acceptors:
2
H Donors:
3
Rotatable Bonds:
1