AG00CA2W

340825-21-0 | 3-Chloro-4-fluorophenethyl alcohol

AG00CA2W

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CAS Number	340825-21-0
Catalog Number	AG00CA2W(AGN-PC-0WAOH6)
Chemical Name	3-Chloro-4-fluorophenethyl alcohol
IUPAC Name	2-(3-chloro-4-fluorophenyl)ethanol
InChI	InChI=1S/C8H8ClFO/c9-7-5-6(3-4-11)1-2-8(7)10/h1-2,5,11H,3-4H2
InChI Key	ZLWGTYVDMGWYEM-UHFFFAOYSA-N
MDL Number	MFCD06201121
Molecular Formula	C8H8ClFO
Molecular Weight	174.5999
SMILES	OCCC1=CC(Cl)=C(F)C=C1
Synonyms	2-(3-chloro-4-fluorophenyl)ethanol, 340825-21-0, 3-Chloro-4-fluorophenethyl alcohol, MFCD06201121, 2-(3-chloro-4-fluorophenyl)ethan-1-ol, AC1MBW5A, SCHEMBL3264645, CTK8A3776, DTXSID80373946, 3-Chloro-4-fluorophenethylalcohol, ZLWGTYVDMGWYEM-UHFFFAOYSA-N, JRD-2018, 4055AB, ANW-65400, SBB088968, ZINC15441045, AKOS006344445, LS11250, 2-(3-chloro-4-fluoro-phenyl)-ethanol, AJ-67336, AS-36919, SC-61367, TC-154145, FT-0691216, I01-8373, C8H8ClFO, 2-(3-chloro-4-fluoro-phenyl)ethanol, CID2757559,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.025g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	174.599g/mol
Monoisotopic Mass	174.025g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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