AG0033DQ

7217-59-6 | 2-Methoxybenzenethiol

AG0033DQ

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CAS Number	7217-59-6
Catalog Number	AG0033DQ(AGN-PC-0WAJ1O)
Chemical Name	2-Methoxybenzenethiol
EC Number	230-605-7
FEMA Number	4159
IUPAC Name	2-methoxybenzenethiol
InChI	InChI=1S/C7H8OS/c1-8-6-4-2-3-5-7(6)9/h2-5,9H,1H3
InChI Key	DSCJETUEDFKYGN-UHFFFAOYSA-N
MDL Number	MFCD00004834
Molecular Formula	C7H8OS
Molecular Weight	140.2028
SMILES	COC1=C(C=CC=C1)S
UNII	90HAL41673
Synonyms	2-methoxybenzenethiol, thioguaiacol, 2-Methoxybenzenethiol, 2-Methoxythiophenol, 7217-59-6, Thioguaiacol, 2-Mercaptoanisole, Benzenethiol, 2-methoxy-, o-Methoxythiophenol, o-Methoxybenzenethiol, 2-Methoxy thiophenol, 2-methoxybenzene-1-thiol, 2-Methoxy-benzenethiol, BENZENETHIOL, o-METHOXY-, UNII-90HAL41673, EINECS 230-605-7, BRN 2042178, DSCJETUEDFKYGN-UHFFFAOYSA-N, MFCD00004834, 90HAL41673, 2-Methoxybenzenethiol, 97%, methoxythiophenol, ortho-thioguaiacol, 2-methoxylthiophenol, 2-methoxy-thiophenol, PubChem6816, O-Methoxy-Benzenethiol, Benzenethiol, methoxy-, AC1L2MSB, 2-Methoxyphenyl mercaptan, ACMC-209om0, 2-Methoxythiophenol, 97%, AC1Q47AC, AC1Q47AD, SCHEMBL8179, 2-Methoxybenzenethiol, 9CI, 4-06-00-05633 (Beilstein Handbook Reference), CHEMBL333973, DTXSID0064595, 2-(methyloxy)phenyl hydrosulfide, CTK0D8690, DSCJETUEDFKYGN-UHFFFAOYSA-, 2-Methoxythiophenol, >=97%, FG, KS-00000X8S, ANW-36166, ZINC19735100, AKOS009156835, MCULE-3733382652, NE10358, PS-5272, RP20630, RTR-023627, TRA0043645, VZ24886, AN-19346, L299, LS-32192, SC-46841, DB-021310, TL8006750, TR-023627, FT-0612872, M1670, EN300-53582, Y11036, W-104497, F0001-1843, InChI=1/C7H8OS/c1-8-6-4-2-3-5-7(6)9/h2-5,9H,1H3, 103171-83-1, C7-H8-O-S, CID23642, 2-Methoxy thiophenol, 97% - 25G 25g,

Complexity	85
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.03g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	140.2g/mol
Monoisotopic Mass	140.03g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	10.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code	UN 3334

Certificate of Analysis

Lot Number