CS-0883754
5-(Cyanomethyl)nicotinic acid
Manufacturer: ChemScene
CAS Number: 170433-33-7
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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=CC(CC#N)=CN=C1)O
Tpsa
73.98
Logp
0.84588
H Acceptors
3
H Donors
1
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
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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=CC(CC#N)=CN=C1)O
Tpsa: 73.98
Logp: 0.84588
H Acceptors: 3
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:
C₈H₆N₂O₂
Molecular Weight:
162.15
Synonyms:
None
SMILES:
O=C(C1=CC(CC#N)=CN=C1)O
Tpsa:
73.98
Logp:
0.84588
H Acceptors:
3
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: C₁₀H₉NO₂
Molecular Weight: 175.18
Synonyms: None
SMILES: O=C(O)C1=CC=C(CCC#N)C=C1
Tpsa: 61.09
Logp: 1.84098
H Acceptors: 2
H Donors: 1
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:
C₁₀H₉NO₂
Molecular Weight:
175.18
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(CCC#N)C=C1
Tpsa:
61.09
Logp:
1.84098
H Acceptors:
2
H Donors:
1
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: C₈H₅FN₂O₂S
Molecular Weight: 212.20
Synonyms: None
SMILES: O=C(O)C1=CC(SC#N)=C(F)C=C1N
Tpsa: 87.11
Logp: 1.67928
H Acceptors: 4
H Donors: 2
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:
C₈H₅FN₂O₂S
Molecular Weight:
212.20
Synonyms:
None
SMILES:
O=C(O)C1=CC(SC#N)=C(F)C=C1N
Tpsa:
87.11
Logp:
1.67928
H Acceptors:
4
H Donors:
2
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: C₈H₇F₂NO₃S
Molecular Weight: 235.21
Synonyms: None
SMILES: O=C(C1=CC=CC(S(=O)(C(F)F)=N)=C1)O
Tpsa: 78.22
Logp: 2.01307
H Acceptors: 3
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:
C₈H₇F₂NO₃S
Molecular Weight:
235.21
Synonyms:
None
SMILES:
O=C(C1=CC=CC(S(=O)(C(F)F)=N)=C1)O
Tpsa:
78.22
Logp:
2.01307
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3