AG00EDBZ

625115-02-8 | 3-Iodo-4-(trifluoromethyl)-pyridine

AG00EDBZ

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CAS Number	625115-02-8
Catalog Number	AG00EDBZ(AGN-PC-04366F)
Chemical Name	3-Iodo-4-(trifluoromethyl)-pyridine
IUPAC Name	3-iodo-4-(trifluoromethyl)pyridine
InChI	InChI=1S/C6H3F3IN/c7-6(8,9)4-1-2-11-3-5(4)10/h1-3H
InChI Key	LIAVQUCOXXXHNI-UHFFFAOYSA-N
MDL Number	MFCD11044367
Molecular Formula	C6H3F3IN
Molecular Weight	272.9944
SMILES	FC(C1=C(I)C=NC=C1)(F)F
Synonyms	3-IODO-4-(TRIFLUOROMETHYL)PYRIDINE, 625115-02-8, 3-Iodo-4-(trifluoromethyl)-pyridine, SCHEMBL5700383, CTK2F1785, DTXSID30634094, MFCD11044367, ZINC42750147, AKOS015891981, Pyridine, 3-iodo-4-(trifluoromethyl)-, AC-23347, AN-27795, DB-002513, FT-0733177, 115I028, I02-2066, Q-101482, 3-Iodo-4- -pyridine, A8640,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	272.926g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	272.997g/mol
Monoisotopic Mass	272.926g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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