CS-0634223
3-Acetylisonicotinic acid
Manufacturer: ChemScene
CAS Number: 1211523-63-5
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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
C₈H₇NO₃
Molecular Weight
165.15
Synonyms
None
SMILES
O=C(C1=C(C(C)=O)C=NC=C1)O
Tpsa
67.26
Logp
0.9824
H Acceptors
3
H Donors
1
Rotatable Bonds
2
Related Products
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: C₈H₇NO₃
Molecular Weight: 165.15
Synonyms: None
SMILES: O=C(C1=C(C(C)=O)C=NC=C1)O
Tpsa: 67.26
Logp: 0.9824
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:
C₈H₇NO₃
Molecular Weight:
165.15
Synonyms:
None
SMILES:
O=C(C1=C(C(C)=O)C=NC=C1)O
Tpsa:
67.26
Logp:
0.9824
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: -20°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆BrNO
Molecular Weight: 200.03
Synonyms: None
SMILES: CC(C1=C(Br)C=CN=C1)=O
Tpsa: 29.96
Logp: 2.0467
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
-20°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆BrNO
Molecular Weight:
200.03
Synonyms:
None
SMILES:
CC(C1=C(Br)C=CN=C1)=O
Tpsa:
29.96
Logp:
2.0467
H Acceptors:
2
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: C₉H₁₀O₃S
Molecular Weight: 198.24
Synonyms: None
SMILES: O=C(OC)C1=CC=C(OC)C=C1S
Tpsa: 35.53
Logp: 1.7705
H Acceptors: 4
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:
C₉H₁₀O₃S
Molecular Weight:
198.24
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C(OC)C=C1S
Tpsa:
35.53
Logp:
1.7705
H Acceptors:
4
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: C₈H₆N₂O
Molecular Weight: 146.15
Synonyms: None
SMILES: N#CC1=NC=CC=C1C(C)=O
Tpsa: 53.75
Logp: 1.15588
H Acceptors: 3
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:
C₈H₆N₂O
Molecular Weight:
146.15
Synonyms:
None
SMILES:
N#CC1=NC=CC=C1C(C)=O
Tpsa:
53.75
Logp:
1.15588
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1