CS-0128514
4,5,6-Trifluoroisophthalonitrile
Manufacturer: ChemScene
CAS Number: 1499756-96-5
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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
C₈HF₃N₂
Molecular Weight
182.10
Synonyms
None
SMILES
N#CC1=C(F)C(F)=C(F)C(C#N)=C1
Tpsa
47.58
Logp
1.84726
H Acceptors
2
H Donors
0
Rotatable Bonds
0
Related Products
SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-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: C₈HF₃N₂
Molecular Weight: 182.10
Synonyms: None
SMILES: N#CC1=C(F)C(F)=C(F)C(C#N)=C1
Tpsa: 47.58
Logp: 1.84726
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:
C₈HF₃N₂
Molecular Weight:
182.10
Synonyms:
None
SMILES:
N#CC1=C(F)C(F)=C(F)C(C#N)=C1
Tpsa:
47.58
Logp:
1.84726
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: C₅HBrF₃N
Molecular Weight: 211.97
Synonyms: None
SMILES: BrC1=CN=C(F)C(F)=C1F
Tpsa: 12.89
Logp: 2.2614
H Acceptors: 1
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:
C₅HBrF₃N
Molecular Weight:
211.97
Synonyms:
None
SMILES:
BrC1=CN=C(F)C(F)=C1F
Tpsa:
12.89
Logp:
2.2614
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD29058964
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₉NO₄
Molecular Weight: 289.33
Synonyms: None
SMILES: O=C(N([C@H](C(OC)=O)C1)CC21CC2)OCC3=CC=CC=C3
Tpsa: 55.84
Logp: 2.3507
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD29058964
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₉NO₄
Molecular Weight:
289.33
Synonyms:
None
SMILES:
O=C(N([C@H](C(OC)=O)C1)CC21CC2)OCC3=CC=CC=C3
Tpsa:
55.84
Logp:
2.3507
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: C₆H₁₁NO
Molecular Weight: 113.16
Synonyms: 1-Azabicyclo[2.2.1]heptan-3-OL
SMILES: O[C@@H]1C[N@]2CC[C@@H]1C2
Tpsa: 23.47
Logp: -0.3172
H Acceptors: 2
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:
C₆H₁₁NO
Molecular Weight:
113.16
Synonyms:
1-Azabicyclo[2.2.1]heptan-3-OL
SMILES:
O[C@@H]1C[N@]2CC[C@@H]1C2
Tpsa:
23.47
Logp:
-0.3172
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0