AG002RJT

26059-40-5 | Benzeneethanol, 2-iodo-

AG002RJT

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CAS Number	26059-40-5
Catalog Number	AG002RJT(AGN-PC-00OGAX)
Chemical Name	Benzeneethanol, 2-iodo-
IUPAC Name	2-(2-iodophenyl)ethanol
InChI	InChI=1S/C8H9IO/c9-8-4-2-1-3-7(8)5-6-10/h1-4,10H,5-6H2
InChI Key	WUQBSMKQSLCUFC-UHFFFAOYSA-N
MDL Number	MFCD11656774
Molecular Formula	C8H9IO
Molecular Weight	248.0609
SMILES	OCCC1=CC=CC=C1I
Synonyms	2-(2-Iodophenyl)ethan-1-ol, 2-(2-iodophenyl)ethanol, 26059-40-5, 2-Iodobenzeneethanol, Benzeneethanol, 2-iodo-, SCHEMBL3164443, WUQBSMKQSLCUFC-UHFFFAOYSA-N, KS-00000S6O, MFCD12031769, ZINC34195301, AKOS022189003, DS-9144, FCH1409617, AJ-87392, AK149280, SY096684, AX8286563, CS-0045354, MFCD12031769 (97%), CID11064750,

Complexity	95.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247.97g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	248.063g/mol
Monoisotopic Mass	247.97g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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