CS-0928871
3-Cyano-5-fluoro-4-methoxybenzoic acid
Manufacturer: ChemScene
CAS Number: 1807161-39-2
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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
C₉H₆FNO₃
Molecular Weight
195.15
Synonyms
None
SMILES
N#CC1=CC(=CC(F)=C1OC)C(=O)O
Tpsa
70.32
Logp
1.40418
H Acceptors
3
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆FNO₃
Molecular Weight: 195.15
Synonyms: None
SMILES: N#CC1=CC(=CC(F)=C1OC)C(=O)O
Tpsa: 70.32
Logp: 1.40418
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:
C₉H₆FNO₃
Molecular Weight:
195.15
Synonyms:
None
SMILES:
N#CC1=CC(=CC(F)=C1OC)C(=O)O
Tpsa:
70.32
Logp:
1.40418
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₈N₂O₄
Molecular Weight: 218.25
Synonyms: None
SMILES: C[C@H](O)C(NCCCC[C@H](N)C(O)=O)=O
Tpsa: 112.65
Logp: -0.9344
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 7
Purity:
97%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₈N₂O₄
Molecular Weight:
218.25
Synonyms:
None
SMILES:
C[C@H](O)C(NCCCC[C@H](N)C(O)=O)=O
Tpsa:
112.65
Logp:
-0.9344
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₉NO₃S
Molecular Weight: 223.25
Synonyms: None
SMILES: N#CC=1C=C(C=C(SC)C1OC)C(=O)O
Tpsa: 70.32
Logp: 1.98698
H Acceptors: 4
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:
C₁₀H₉NO₃S
Molecular Weight:
223.25
Synonyms:
None
SMILES:
N#CC=1C=C(C=C(SC)C1OC)C(=O)O
Tpsa:
70.32
Logp:
1.98698
H Acceptors:
4
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: C₈H₅Br₂N₃O₂
Molecular Weight: 334.95
Synonyms: None
SMILES: O=N(=O)C=1C=C(Br)C=2N=C(NC2C1Br)C
Tpsa: 71.82
Logp: 3.30452
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:
C₈H₅Br₂N₃O₂
Molecular Weight:
334.95
Synonyms:
None
SMILES:
O=N(=O)C=1C=C(Br)C=2N=C(NC2C1Br)C
Tpsa:
71.82
Logp:
3.30452
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1