CS-0779604
3-(Fluoromethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 1644645-49-7
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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
C₁₄H₁₇BFNO₂
Molecular Weight
261.10
Synonyms
None
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)C#N)CF
Tpsa
42.25
Logp
2.32698
H Acceptors
3
H Donors
0
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: C₁₄H₁₇BFNO₂
Molecular Weight: 261.10
Synonyms: None
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)C#N)CF
Tpsa: 42.25
Logp: 2.32698
H Acceptors: 3
H Donors: 0
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:
C₁₄H₁₇BFNO₂
Molecular Weight:
261.10
Synonyms:
None
SMILES:
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)C#N)CF
Tpsa:
42.25
Logp:
2.32698
H Acceptors:
3
H Donors:
0
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: C₁₀H₁₄ClN
Molecular Weight: 183.68
Synonyms: None
SMILES: C[C@H]1CCC2=CC=CC=C2N1.Cl
Tpsa: 12.03
Logp: 2.855
H Acceptors: 1
H Donors: 1
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:
C₁₀H₁₄ClN
Molecular Weight:
183.68
Synonyms:
None
SMILES:
C[C@H]1CCC2=CC=CC=C2N1.Cl
Tpsa:
12.03
Logp:
2.855
H Acceptors:
1
H Donors:
1
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: C₁₇H₂₄BrN
Molecular Weight: 322.28
Synonyms: None
SMILES: CC1=C(C=[N+](C=C1)C23CC4CC(C2)CC(C4)C3)C.[Br-]
Tpsa: 3.88
Logp: 0.52024
H Acceptors: 0
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:
C₁₇H₂₄BrN
Molecular Weight:
322.28
Synonyms:
None
SMILES:
CC1=C(C=[N+](C=C1)C23CC4CC(C2)CC(C4)C3)C.[Br-]
Tpsa:
3.88
Logp:
0.52024
H Acceptors:
0
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: C₁₁H₁₈O₄
Molecular Weight: 214.26
Synonyms: None
SMILES: CC1(O[C@H](C[C@H](O1)C=C)CC(=O)OC)C
Tpsa: 44.76
Logp: 1.6457
H Acceptors: 4
H Donors: 0
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:
C₁₁H₁₈O₄
Molecular Weight:
214.26
Synonyms:
None
SMILES:
CC1(O[C@H](C[C@H](O1)C=C)CC(=O)OC)C
Tpsa:
44.76
Logp:
1.6457
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3