AG002GK9

1879-16-9 | Benzene, 1-​methoxy-​4-​(methylthio)​-

AG002GK9

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CAS Number	1879-16-9
Catalog Number	AG002GK9(AGN-PC-0CFKEA)
Chemical Name	Benzene, 1-​methoxy-​4-​(methylthio)​-
IUPAC Name	1-methoxy-4-methylsulfanylbenzene
InChI	InChI=1S/C8H10OS/c1-9-7-3-5-8(10-2)6-4-7/h3-6H,1-2H3
InChI Key	DQNSKXYRRRCKGH-UHFFFAOYSA-N
MDL Number	MFCD00010587
Molecular Formula	C8H10OS
Molecular Weight	154.2294
NSC Number	124839
SMILES	O(C)c1ccc(cc1)SC
Synonyms	1-methoxy-4-(methylthio)benzene, MMTB, 4-Methoxythioanisole, 1879-16-9, 1-Methoxy-4-(methylthio)benzene, 4-(Methylthio)anisole, Benzene, 1-methoxy-4-(methylthio)-, p-(Methylthio)anisole, p-Anisyl methyl sulfide, p-Methoxyphenyl methyl sulfide, 1-Methoxy-4-methylthiobenzene, Anisole, p-(methylthio)-, 4-Methoxy thioanisole, Methyl p-methoxyphenyl sulfide, Methyl 4-methoxyphenyl sulfide, (4-methoxyphenyl)(methyl)sulfane, 1-methoxy-4-methylsulfanyl-benzene, 1-Methoxy-4-(methylsulfanyl)benzene, P-METHOXYTHIOANISOLE, NSC 124839, 4-Methoxythiophenol, S-methyl-, 1-methoxy-4-methylsulfanylbenzene, DQNSKXYRRRCKGH-UHFFFAOYSA-N, MMTB, PubChem10655, Methyl p-anisyl sulfide, ACMC-1CIDW, AC1L26TU, 4-Methoxythioanisole, 97%, KSC490K3N, 4-methoxy-1-methylthiobenzene, 4-methoxyphenyl methyl sulfide, SCHEMBL1145983, CTK3J0536, KS-00000UCH, DTXSID40172114, Methyl (4-methoxyphenyl) sulfide, ZINC409171, Anisole, p-(methylthio)- (8CI), ANW-23375, MFCD00010587, NSC124839, AKOS006220697, 1-Methoxy-4-(methylsulfanyl)benzene #, AS04296, MCULE-8656476029, NSC-124839, RP21868, RTR-008694, TRA0068945, VZ29355, AC-16436, AN-50043, CJ-04166, I355, ZB013843, AB0013642, TR-008694, Benzene, 1-methoxy-4-(methylthio)- (9CI), FT-0676132, M1852, ST51041423, C-4847, A813190, I09-1420, J-504837, InChI=1/C8H10OS/c1-9-7-3-5-8(10-2)6-4-7/h3-6H,1-2H, C8H10OS, C8-H10-O-S, CID15885, ZINC00409171, 1-Methoxy-4-(methylthio)benzene, 99% - 25G 25g,

Complexity	87.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	154.045g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.227g/mol
Monoisotopic Mass	154.045g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	34.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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