AG003GT3

19614-16-5 | 1-Bromo-2-(methylsulfanyl)benzene

AG003GT3

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CAS Number	19614-16-5
Catalog Number	AG003GT3(AGN-PC-07H7TT)
Chemical Name	1-Bromo-2-(methylsulfanyl)benzene
EC Number	243-183-4
IUPAC Name	1-bromo-2-methylsulfanylbenzene
InChI	InChI=1S/C7H7BrS/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChI Key	ALAQDUSTXPEHMH-UHFFFAOYSA-N
MDL Number	MFCD00000066
Molecular Formula	C7H7BrS
Molecular Weight	203.0995
SMILES	CSC1=CC=CC=C1Br
Synonyms	2-bromothioanisole, o-bromothioanisole, 2-Bromothioanisole, 19614-16-5, 2-bromo thioanisole, 1-Bromo-2-(methylthio)benzene, o-Bromothioanisole, 2-Bromophenyl methyl sulfide, Benzene, 1-bromo-2-(methylthio)-, 1-Bromo-2-(methylsulfanyl)benzene, 2-Bromophenyl methyl sulphide, 1-bromo-2-methylsulfanylbenzene, MFCD00000066, o-Bromo(methylthio)benzene, (2-bromophenyl)(methyl)sulfane, 1-Bromo-2-methylsulfanyl-benzene, 2-(METHYLTHIO)BROMOBENZENE, ALAQDUSTXPEHMH-UHFFFAOYSA-N, 1-bromo-2-methylthiobenzene, bromothioanisole, 2-bromo-thioanisole, EINECS 243-183-4, ortho-bromothioanisole, PubChem10648, AC1Q4GUL, ACMC-1C5IP, 2-Bromothioanisole, 97%, AC1L3F5Q, 1-methylthio-2-bromobenzene, o-Bromophenyl methyl sulfide, CHEMWISH IC04034, KSC490K3J, Sulfide, o-bromophenyl methyl, SCHEMBL890738, Methyl (2-bromophenyl) sulfide, 1-bromo-2-(methylthio) benzene, CTK3J0534, TIMTEC-BB SBB006566, DTXSID70173275, ZINC409185, 1-bromanyl-2-methylsulfanyl-benzene, 1-Bromo-2-(methylsulphanyl)benzene, ACN-S004403, KS-00000V9T, ANW-23708, SBB006566, TF1047, 1-Bromo-2-(methylsulfanyl)benzene #, AKOS015835166, AS04291, LS11369, MCULE-9688762859, PS-4724, RP26008, RTR-009110, TRA0057622, BC003551, CJ-04171, N619, SC-25770, SY001522, ZB013853, AB0015919, DB-044926, TR-009110, FT-0611617, ST50405116, MFCD00000066 (98%), Y-8596, A813836, I09-1422, J-508557, J-512146, InChI=1/C7H7BrS/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H, 3-Bromothioanisole, 3-Bromo-thioanisole, C7H7BrS, C7-H7-Br-S, o-Bromophenyl methyl sulphide, CID88166, 2-Bromothioanisole, 98% - 25G 25g, B2023, 33733-73-2,

Complexity	85
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.945g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.097g/mol
Monoisotopic Mass	201.945g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	25.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number