AG00007V

100-84-5 | 1-Methoxy-3-methylbenzene

AG00007V

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CAS Number	100-84-5
Catalog Number	AG00007V(AGN-PC-0D7ELK)
Chemical Name	1-Methoxy-3-methylbenzene
EC Number	202-893-4
IUPAC Name	1-methoxy-3-methylbenzene
InChI	InChI=1S/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3
InChI Key	OSIGJGFTADMDOB-UHFFFAOYSA-N
MDL Number	MFCD00008395
Molecular Formula	C8H10O
Molecular Weight	122.1644
NSC Number	6255
SMILES	O(c1cccc(c1)C)C
UNII	UI9I3Y6WTZ
Synonyms	3-methoxytoluene, 3-Methylanisole, 1-Methoxy-3-methylbenzene, 100-84-5, 3-Methoxytoluene, m-Methylanisole, m-Cresol methyl ether, Benzene, 1-methoxy-3-methyl-, m-Cresyl methyl ether, M-METHOXYTOLUENE, Methyl m-tolyl ether, Methyl m-cresyl ether, Anisole, m-methyl-, 3-Methylmethoxybenzene, Methyl 3-methylphenyl ether, 1-Methyl-3-methoxybenzene, 1-Methoxy-3-methyl-benzene, UNII-UI9I3Y6WTZ, NSC 6255, EINECS 202-893-4, UI9I3Y6WTZ, 3-Methyl-1-methoxybenzene, AI3-19476, CHEMBL349791, OSIGJGFTADMDOB-UHFFFAOYSA-N, MFCD00008395, 3-methoxy-1-methylbenzene, m-Methyl anisole, 3-methyl anisole, Meta-Methylanisole, 3-methoxy toluene, 3-Cresol methyl ether, 3-Methylanisole, 99%, AC1L1OYY, META METHOXYTOLUENE, ACMC-1C3GF, METHYL-M-TOLYL ETHER, SCHEMBL12353, Jsp000166, DTXSID2051500, SCHEMBL12015250, CTK1A5099, KS-00000EVT, NSC6255, LABOTEST-BB LTBB003020, NSC-6255, STR09347, ZINC1693360, 7907AF, ANW-14378, BDBM50008537, SBB061028, AKOS000121157, META-CRESOL DEUTEROMETHYL ETHER, AS01016, FR-1366, MCULE-7649681864, RP19469, RTR-000255, TRA0054603, AJ-30191, CJ-06539, CJ-28311, LS-20215, SC-22692, DB-012728, TR-000255, FT-0628957, M0151, ST24038069, ST51047105, A800280, I01-5100, W-108936, F0001-0028, InChI=1/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H, 3-methylanisol, C8H10O, CID7530, C8-H10-O, ACN-050501, 3-Methylanisole, 99% - 100G 100g, 20369-34-0,

Complexity	80.6
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	122.073g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	122.167g/mol
Monoisotopic Mass	122.073g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H302
Packing Group	Ⅲ
Precautionary statements	P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

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