AG0033NS

855403-42-8 | 3-Chloro-4-iodophenol

AG0033NS

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CAS Number	855403-42-8
Catalog Number	AG0033NS(AGN-PC-0HFYOS)
Chemical Name	3-Chloro-4-iodophenol
IUPAC Name	3-chloro-4-iodophenol
InChI	InChI=1S/C6H4ClIO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H
InChI Key	DIBGHLUZOSSRIT-UHFFFAOYSA-N
MDL Number	MFCD17000018
Molecular Formula	C6H4ClIO
Molecular Weight	254.4528
SMILES	ClC=1C=C(C=CC1I)O
Synonyms	3-CHLORO-4-IODOPHENOL, 855403-42-8, 3-Chloro-4-iodo phenol, SCHEMBL2552190, KS-000000WH, MFCD17000018, ZINC95644790, AKOS025396420, AS06504, CM10112, DS-8688, MB25466, AK174296, QC-11458, SC-65761, CS-0041410,

Complexity	99.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	253.9g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	254.451g/mol
Monoisotopic Mass	253.9g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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