CS-0887008
tert-Butyl 2-cyano-5-fluorobenzoate
Manufacturer: ChemScene
CAS Number: 2913423-16-0
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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
C₁₂H₁₂FNO₂
Molecular Weight
221.23
Synonyms
None
SMILES
O=C(OC(C)(C)C)C1=CC(F)=CC=C1C#N
Tpsa
50.09
Logp
2.65268
H Acceptors
3
H Donors
0
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: C₁₂H₁₂FNO₂
Molecular Weight: 221.23
Synonyms: None
SMILES: O=C(OC(C)(C)C)C1=CC(F)=CC=C1C#N
Tpsa: 50.09
Logp: 2.65268
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:
C₁₂H₁₂FNO₂
Molecular Weight:
221.23
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)C1=CC(F)=CC=C1C#N
Tpsa:
50.09
Logp:
2.65268
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: C₁₇H₁₃NO
Molecular Weight: 247.29
Synonyms: None
SMILES: COC1=CC2=C(NC3=C2C=CC4=CC=CC=C34)C=C1
Tpsa: 25.02
Logp: 4.4829
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:
C₁₇H₁₃NO
Molecular Weight:
247.29
Synonyms:
None
SMILES:
COC1=CC2=C(NC3=C2C=CC4=CC=CC=C34)C=C1
Tpsa:
25.02
Logp:
4.4829
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: C₁₂H₁₃NO₃
Molecular Weight: 219.24
Synonyms: None
SMILES: O=C(OC(C)(C)C)C1=CC=C(C#N)C=C1O
Tpsa: 70.32
Logp: 2.21918
H Acceptors: 4
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:
C₁₂H₁₃NO₃
Molecular Weight:
219.24
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)C1=CC=C(C#N)C=C1O
Tpsa:
70.32
Logp:
2.21918
H Acceptors:
4
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: C₁₁H₁₂N₂O₂
Molecular Weight: 204.23
Synonyms: None
SMILES: O=C(C1=CC=C(C#N)N=C1)OC(C)(C)C
Tpsa: 62.98
Logp: 1.90858
H Acceptors: 4
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:
C₁₁H₁₂N₂O₂
Molecular Weight:
204.23
Synonyms:
None
SMILES:
O=C(C1=CC=C(C#N)N=C1)OC(C)(C)C
Tpsa:
62.98
Logp:
1.90858
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1