AG00DBRJ

501-29-1 | 4-Chloro-3-fluoroanisole

AG00DBRJ

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CAS Number	501-29-1
Catalog Number	AG00DBRJ(AGN-PC-0KK0BO)
Chemical Name	4-Chloro-3-fluoroanisole
IUPAC Name	1-chloro-2-fluoro-4-methoxybenzene
InChI	InChI=1S/C7H6ClFO/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChI Key	FAVMSTGWFRDCRR-UHFFFAOYSA-N
MDL Number	MFCD00042570
Molecular Formula	C7H6ClFO
Molecular Weight	160.5733
SMILES	COC1=CC=C(Cl)C(F)=C1
Synonyms	4-Chloro-3-fluoroanisole, 501-29-1, 1-chloro-2-fluoro-4-methoxybenzene, 3-Fluoro-4-chloroanisole, FAVMSTGWFRDCRR-UHFFFAOYSA-N, Benzene, 1-chloro-2-fluoro-4-methoxy-, 1-CHLORO-2-FLUORO-4-METHOXY-BENZENE, PubChem2663, ACMC-209kk8, AC1MC53H, KSC494A3T, SCHEMBL276095, SCHEMBL12015245, CTK3J4039, chloro-2-fluoro-4-methoxybenzene, DTXSID20369146, ACT01015, ZINC2584354, ANW-30918, BBL101409, MFCD00042570, SBB087475, STL555205, WT1891, AKOS005258284, 501-29-1 4-chloro-3-fluoroanisole, AM62549, AS02727, AS04171, CM11682, CS-W010874, MCULE-5010129027, PS-8771, KS-00000D70, AJ-43420, AK-53797, BP-11135, BR-53797, CJ-10360, SC-04860, SY021841, AB0030051, RT-001830, ST2415288, 4CH-015888, FT-0618063, ST50405471, X2239, MFCD00042570 (95%), A19906, S-1450, C7H6ClFO, cc-112, (2-(dimethylamino)phenyl)methanol, c1273, ZINC02584354, ACN-050492, CID2724521,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.009g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	160.572g/mol
Monoisotopic Mass	160.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number