CS-0895392
2-Cyano-5-(trifluoromethyl)isonicotinic acid
Manufacturer: ChemScene
CAS Number: 1803711-16-1
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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
C₈H₃F₃N₂O₂
Molecular Weight
216.12
Synonyms
None
SMILES
N#CC1=NC=C(C(=C1)C(=O)O)C(F)(F)F
Tpsa
73.98
Logp
1.67028
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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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
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: C₈H₃F₃N₂O₂
Molecular Weight: 216.12
Synonyms: None
SMILES: N#CC1=NC=C(C(=C1)C(=O)O)C(F)(F)F
Tpsa: 73.98
Logp: 1.67028
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:
C₈H₃F₃N₂O₂
Molecular Weight:
216.12
Synonyms:
None
SMILES:
N#CC1=NC=C(C(=C1)C(=O)O)C(F)(F)F
Tpsa:
73.98
Logp:
1.67028
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD01114795
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂N₂S
Molecular Weight: 240.32
Synonyms: None
SMILES: N1=C(SC=C1C=2C=CC(=C3C=CC=CC23)C)N
Tpsa: 38.91
Logp: 3.85392
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD01114795
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂N₂S
Molecular Weight:
240.32
Synonyms:
None
SMILES:
N1=C(SC=C1C=2C=CC(=C3C=CC=CC23)C)N
Tpsa:
38.91
Logp:
3.85392
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD28357218
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₅NO₃
Molecular Weight: 175.14
Synonyms: None
SMILES: N#CC=1C(C=O)=CC=CC1C(=O)O
Tpsa: 78.16
Logp: 1.06898
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28357218
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₅NO₃
Molecular Weight:
175.14
Synonyms:
None
SMILES:
N#CC=1C(C=O)=CC=CC1C(=O)O
Tpsa:
78.16
Logp:
1.06898
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: C₁₄H₁₉NO₄
Molecular Weight: 265.30
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CC2=CC(O)=C(O)C=C2CC1
Tpsa: 70
Logp: 2.391
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₉NO₄
Molecular Weight:
265.30
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CC2=CC(O)=C(O)C=C2CC1
Tpsa:
70
Logp:
2.391
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
0