CS-0578633
6-(Tert-butyl)-2-chloro-4-(trifluoromethyl)nicotinonitrile
Manufacturer: ChemScene
CAS Number: 914208-21-2
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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
C₁₁H₁₀ClF₃N₂
Molecular Weight
262.66
Synonyms
6-TERT-BUTYL-2-CHLORO-4-(TRIFLUOROMETHYL)NICOTINONITRILE
SMILES
CC(C)(C)C1=NC(=C(C(=C1)C(F)(F)F)C#N)Cl
Tpsa
36.68
Logp
3.92298
H Acceptors
2
H Donors
0
Rotatable Bonds
0
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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: C₁₁H₁₀ClF₃N₂
Molecular Weight: 262.66
Synonyms: 6-TERT-BUTYL-2-CHLORO-4-(TRIFLUOROMETHYL)NICOTINONITRILE
SMILES: CC(C)(C)C1=NC(=C(C(=C1)C(F)(F)F)C#N)Cl
Tpsa: 36.68
Logp: 3.92298
H Acceptors: 2
H Donors: 0
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:
C₁₁H₁₀ClF₃N₂
Molecular Weight:
262.66
Synonyms:
6-TERT-BUTYL-2-CHLORO-4-(TRIFLUOROMETHYL)NICOTINONITRILE
SMILES:
CC(C)(C)C1=NC(=C(C(=C1)C(F)(F)F)C#N)Cl
Tpsa:
36.68
Logp:
3.92298
H Acceptors:
2
H Donors:
0
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: C₁₀H₇BrN₂O₂
Molecular Weight: 267.08
Synonyms: None
SMILES: C1=CC2=C(C=C(C(=C2N=C1)N)C(=O)O)Br
Tpsa: 76.21
Logp: 2.2777
H Acceptors: 3
H Donors: 2
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:
C₁₀H₇BrN₂O₂
Molecular Weight:
267.08
Synonyms:
None
SMILES:
C1=CC2=C(C=C(C(=C2N=C1)N)C(=O)O)Br
Tpsa:
76.21
Logp:
2.2777
H Acceptors:
3
H Donors:
2
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: C₉H₁₀ClFO₂
Molecular Weight: 204.63
Synonyms: 4,5-DIMETHOXY-2-FLUOROBENZYL CHLORIDE
SMILES: COC1=C(C=C(C(=C1)CCl)F)OC
Tpsa: 18.46
Logp: 2.5817
H Acceptors: 2
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:
C₉H₁₀ClFO₂
Molecular Weight:
204.63
Synonyms:
4,5-DIMETHOXY-2-FLUOROBENZYL CHLORIDE
SMILES:
COC1=C(C=C(C(=C1)CCl)F)OC
Tpsa:
18.46
Logp:
2.5817
H Acceptors:
2
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: C₁₇H₂₄FN₃O₃
Molecular Weight: 337.39
Synonyms: tert-Butyl 4-[3-(4-fluorophenyl)ureido]piperidine-1-carboxylate
SMILES: O=C(N1CCC(NC(NC2=CC=C(F)C=C2)=O)CC1)OC(C)(C)C
Tpsa: 70.67
Logp: 3.3467
H Acceptors: 3
H Donors: 2
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:
C₁₇H₂₄FN₃O₃
Molecular Weight:
337.39
Synonyms:
tert-Butyl 4-[3-(4-fluorophenyl)ureido]piperidine-1-carboxylate
SMILES:
O=C(N1CCC(NC(NC2=CC=C(F)C=C2)=O)CC1)OC(C)(C)C
Tpsa:
70.67
Logp:
3.3467
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2