CS-0881964
2-Chloro-3-(methoxycarbonyl)isonicotinic acid
Manufacturer: ChemScene
CAS Number: 2091601-28-2
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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
C₈H₆ClNO₄
Molecular Weight
215.59
Synonyms
None
SMILES
O=C(C1=C(C(O)=O)C=CN=C1Cl)OC
Tpsa
76.49
Logp
1.2198
H Acceptors
4
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₈H₆ClNO₄
Molecular Weight: 215.59
Synonyms: None
SMILES: O=C(C1=C(C(O)=O)C=CN=C1Cl)OC
Tpsa: 76.49
Logp: 1.2198
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:
C₈H₆ClNO₄
Molecular Weight:
215.59
Synonyms:
None
SMILES:
O=C(C1=C(C(O)=O)C=CN=C1Cl)OC
Tpsa:
76.49
Logp:
1.2198
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: C₉H₇F₂IO₂
Molecular Weight: 312.05
Synonyms: None
SMILES: O=C(OC)C1=C(C)C=C(F)C(F)=C1I
Tpsa: 26.3
Logp: 2.66442
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:
C₉H₇F₂IO₂
Molecular Weight:
312.05
Synonyms:
None
SMILES:
O=C(OC)C1=C(C)C=C(F)C(F)=C1I
Tpsa:
26.3
Logp:
2.66442
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: C₈H₅F₂IO₂
Molecular Weight: 298.03
Synonyms: None
SMILES: O=C(O)C1=C(C)C=C(F)C(F)=C1I
Tpsa: 37.3
Logp: 2.57602
H Acceptors: 1
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:
C₈H₅F₂IO₂
Molecular Weight:
298.03
Synonyms:
None
SMILES:
O=C(O)C1=C(C)C=C(F)C(F)=C1I
Tpsa:
37.3
Logp:
2.57602
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈N₂O₄
Molecular Weight: 184.15
Synonyms: None
SMILES: O=C(C1=C(C(O)=O)N(C)C=N1)OC
Tpsa: 81.42
Logp: -0.0951
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈N₂O₄
Molecular Weight:
184.15
Synonyms:
None
SMILES:
O=C(C1=C(C(O)=O)N(C)C=N1)OC
Tpsa:
81.42
Logp:
-0.0951
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2