CAS
95152-79-7 Purity
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95152-79-7 Purity
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3-Pyridinecarbonitrile,5-(trifluoromethyl)-
CAS
951624-83-2
Catalog Number
ACM951624832
Category
Other Products
Molecular Weight
172.1073296
Molecular Formula
C7H3F3N2
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Specification
Synonyms
5-(Trifluoromethyl)nicotinonitrile, 951624-83-2, 5-(trifluoromethyl)pyridine-3-carbonitrile, ACMC-20am7n, SureCN2749165, CTK5H7430, MolPort-003-993-533, MAY00107, SBB088575, ZINC19735881, AKOS005254481, AG-H-92017, RP02706, AK-36966, KB-244032, FT-0678114, Y4824, I14-29451
IUPAC Name
5-(trifluoromethyl)pyridine-3-carbonitrile
Canonical SMILES
C1=C(C=NC=C1C(F)(F)F)C#N
InChI Key
HAWFNLPVIMFXGB-UHFFFAOYSA-N
Boiling Point
204.4ºC at 760 mmHg
Melting Point
46-47ºC
Flash Point
77.4ºC
Density
1.37g/cm³
Exact Mass
172.02500
Hazard Statements
Xi
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of 3-Pyridinecarbonitrile, 5-(trifluoromethyl)?
The molecular formula of 3-Pyridinecarbonitrile, 5-(trifluoromethyl) is C7H3F3N2.
What are some synonyms of 3-Pyridinecarbonitrile, 5-(trifluoromethyl)?
Some synonyms of 3-Pyridinecarbonitrile, 5-(trifluoromethyl) include 5-(Trifluoromethyl)nicotinonitrile, 951624-83-2, and 3-cyano-5-(trifluoromethyl)pyridine.
What is the molecular weight of 3-Pyridinecarbonitrile, 5-(trifluoromethyl)?
The molecular weight of 3-Pyridinecarbonitrile, 5-(trifluoromethyl) is 172.11 g/mol.
What is the InChIKey of 3-Pyridinecarbonitrile, 5-(trifluoromethyl)?
The InChIKey of 3-Pyridinecarbonitrile, 5-(trifluoromethyl) is HAWFNLPVIMFXGB-UHFFFAOYSA-N.
What is the XLogP3-AA value of 3-Pyridinecarbonitrile, 5-(trifluoromethyl)?
The XLogP3-AA value of 3-Pyridinecarbonitrile, 5-(trifluoromethyl) is 1.5.
How many hydrogen bond acceptor counts does 3-Pyridinecarbonitrile, 5-(trifluoromethyl) have?
3-Pyridinecarbonitrile, 5-(trifluoromethyl) has 5 hydrogen bond acceptor counts.
What is the topological polar surface area of 3-Pyridinecarbonitrile, 5-(trifluoromethyl)?
The topological polar surface area of 3-Pyridinecarbonitrile, 5-(trifluoromethyl) is 36.7 Å2.
How many heavy atoms does 3-Pyridinecarbonitrile, 5-(trifluoromethyl) contain?
3-Pyridinecarbonitrile, 5-(trifluoromethyl) contains 12 heavy atoms.
Is the compound canonicalized?
Yes, the compound is canonicalized.
When was 3-Pyridinecarbonitrile, 5-(trifluoromethyl) created and last modified?
3-Pyridinecarbonitrile, 5-(trifluoromethyl) was created on 2009-05-28 and last modified on 2023-12-30.
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