AG00E9DF

6161-87-1 | 2-(2,4,6-Trichlorophenoxy)ethanol

AG00E9DF

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CAS Number	6161-87-1
Catalog Number	AG00E9DF(AGN-PC-0JM1U3)
Chemical Name	2-(2,4,6-Trichlorophenoxy)ethanol
IUPAC Name	2-(2,4,6-trichlorophenoxy)ethanol
InChI	InChI=1S/C8H7Cl3O2/c9-5-3-6(10)8(7(11)4-5)13-2-1-12/h3-4,12H,1-2H2
InChI Key	LZTZSANFAWWCRW-UHFFFAOYSA-N
MDL Number	MFCD02231270
Molecular Formula	C8H7Cl3O2
Molecular Weight	241.4990
NSC Number	68796
SMILES	ClC1=C(OCCO)C(Cl)=CC(Cl)=C1
Synonyms	2-(2,4,6-Trichlorophenoxy)ethanol, 6161-87-1, 2-(2,4,6-trichlorophenoxy)ethan-1-ol, Ethanol, 2-(2,4,6-trichlorophenoxy)-, NSC68796, AI3-09182, AC1L3W8W, AC1Q3MB9, AC1Q7D7Y, NCIOpen2_003446, Oprea1_163213, Oprea1_433452, SCHEMBL9349699, CTK5B3489, KS-00000MDY, DTXSID50210632, LZTZSANFAWWCRW-UHFFFAOYSA-N, ZINC1695289, MFCD02231270, NSC-68796, 2-(2,4,6-trichlorophenoxy) ethanol, 2-(2,4,6-trichlorophenoxy)-ethanol, AKOS000540780, DS-7045, MCULE-4399514841, NE39725, 2-(2,4,6-Trichloro-phenoxy)-ethanol, Ethanol,2-(2,4,6-trichlorophenoxy)-, AC-12570, AJ-30278, AK140427, BAS 02374266, CJ-28435, Ethanol, 2-(2,4,6-trichlorophenoxy)-,, ST50012958, EN300-62659, Z993967024, C8-H7-Cl3-O2, CID96343, AR-1C6341, 62862-32-2,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.951g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	241.492g/mol
Monoisotopic Mass	239.951g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

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

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