CS-1161677
2-Cyano-3-(difluoromethyl)-5-fluorobenzoic acid
Manufacturer: ChemScene
CAS Number: 1807300-73-7
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₄F₃NO₂
Molecular Weight
215.13
Synonyms
None
SMILES
N#CC=1C(=CC(F)=CC1C(F)F)C(=O)O
Tpsa
61.09
Logp
2.33318
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₄F₃NO₂
Molecular Weight: 215.13
Synonyms: None
SMILES: N#CC=1C(=CC(F)=CC1C(F)F)C(=O)O
Tpsa: 61.09
Logp: 2.33318
H Acceptors: 2
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:
C₉H₄F₃NO₂
Molecular Weight:
215.13
Synonyms:
None
SMILES:
N#CC=1C(=CC(F)=CC1C(F)F)C(=O)O
Tpsa:
61.09
Logp:
2.33318
H Acceptors:
2
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: C₈H₇F₂IN₂O₂
Molecular Weight: 328.06
Synonyms: None
SMILES: O=C(N)C1=C(I)C(=NC=C1OC)C(F)F
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇F₂IN₂O₂
Molecular Weight:
328.06
Synonyms:
None
SMILES:
O=C(N)C1=C(I)C(=NC=C1OC)C(F)F
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆F₂N₂O₄
Molecular Weight: 232.14
Synonyms: None
SMILES: O=C(O)C=1C(=CN=C(C1C)C(F)F)N(=O)=O
Tpsa: 93.33
Logp: 1.93402
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆F₂N₂O₄
Molecular Weight:
232.14
Synonyms:
None
SMILES:
O=C(O)C=1C(=CN=C(C1C)C(F)F)N(=O)=O
Tpsa:
93.33
Logp:
1.93402
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉F₂N₃O
Molecular Weight: 201.18
Synonyms: None
SMILES: O=C(N)C1=NC(N)=C(C(=C1)C)C(F)F
Tpsa: 82
Logp: 1.00872
H Acceptors: 3
H Donors: 2
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:
C₈H₉F₂N₃O
Molecular Weight:
201.18
Synonyms:
None
SMILES:
O=C(N)C1=NC(N)=C(C(=C1)C)C(F)F
Tpsa:
82
Logp:
1.00872
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2