AG003E7X

7051-16-3 | Benzene, 1-​chloro-​3,​5-​dimethoxy-

AG003E7X

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CAS Number	7051-16-3
Catalog Number	AG003E7X(AGN-PC-0JLTAH)
Chemical Name	Benzene, 1-​chloro-​3,​5-​dimethoxy-
EC Number	230-330-2
IUPAC Name	1-chloro-3,5-dimethoxybenzene
InChI	InChI=1S/C8H9ClO2/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5H,1-2H3
InChI Key	WQHNWJBSROXROL-UHFFFAOYSA-N
MDL Number	MFCD00008382
Molecular Formula	C8H9ClO2
Molecular Weight	172.6089
NSC Number	220095
SMILES	O(C)c1cc(OC)cc(c1)Cl
Synonyms	1-Chloro-3,5-dimethoxybenzene, 7051-16-3, 5-Chloro-1,3-dimethoxybenzene, 3,5-Dimethoxychlorobenzene, Benzene, 1-chloro-3,5-dimethoxy-, 5-Chlororesorcinol dimethyl ether, NSC 220095, EINECS 230-330-2, BRN 2327304, 1,3-dimethoxy-5-chlorobenzene, WQHNWJBSROXROL-UHFFFAOYSA-N, MFCD00008382, AK-76948, NSC220095, PubChem3042, Benzene,5-dimethoxy-, ACMC-209oev, AC1Q3MNW, AC1L31GM, WLN: GR CO1 EO1, SCHEMBL21263, 3,5-dimethoxyphenyl chloride, chloro-3,5-dimethyoxybenzene, KSC912E0F, 1-Chloro-3,5-dimethoxy-benzene, CTK8B2202, WQHNWJBSROXROL-UHFFFAOYSA-, DTXSID80220784, ZINC407003, ZX-AT006472, ANW-35909, BBL101373, OR4352, STL555169, TD1305, AKOS005258169, 5-Chloro-1,3-dimethoxybenzene, 97%, AS02697, FCH1117698, FS-3675, MCULE-7262147291, NSC-220095, TRA-0184064, AC-28510, AJ-22553, CC-04352, CJ-04111, LS-29472, ZB013737, AB0059272, AX8057791, DB-055422, ST2415296, TR-033332, FT-0620333, ST50406409, Z5056, KS-00001150, A20790, M-4468, C-31411, 2-Chloro-1-phenyl-1-propanone;2-Chloro-1-phenylpropan-1-one, InChI=1/C8H9ClO2/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5H,1-2H3, 2-Chloropropiophenone, C8H9ClO2, O(C)c1cc(Cl)cc(OC)c1, C8-H9-Cl-O2, CID81502, AR-1C2326, c1258, 4-06-00-05684 (Beilstein Handbook Reference), 6084-17-9, 72828-82-1,

Complexity	107
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.029g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	172.608g/mol
Monoisotopic Mass	172.029g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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