AG003N0W

13414-95-4 | 6,7-Dihydro-5H-benzo[b]thiophen-4-one

AG003N0W

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CAS Number	13414-95-4
Catalog Number	AG003N0W(AGN-PC-0JLUIQ)
Chemical Name	6,7-Dihydro-5H-benzo[b]thiophen-4-one
EC Number	236-510-7
IUPAC Name	6,7-dihydro-5H-1-benzothiophen-4-one
InChI	InChI=1S/C8H8OS/c9-7-2-1-3-8-6(7)4-5-10-8/h4-5H,1-3H2
InChI Key	GJEKNELSXNSYAQ-UHFFFAOYSA-N
MDL Number	MFCD00005861
Molecular Formula	C8H8OS
Molecular Weight	152.2135
NSC Number	99002
SMILES	O=C1CCCC2=C1C=CS2
Synonyms	13414-95-4, 6,7-Dihydro-4-benzo[b]thiophenone, 6,7-dihydro-5H-benzo[b]thiophen-4-one, 4-Keto-4,5,6,7-tetrahydrothianaphthene, 6,7-Dihydrobenzo[b]thiophen-4(5H)-one, 6,7-Dihydrobenzo[b]thiophen-4-one, 6,7-Dihydro-1-benzothiophen-4(5H)-one, Benzo[b]thiophen-4(5H)-one, 6,7-dihydro-, 4,5,6,7-Tetrahydrothionaphthen-4-one, NSC99002, 4,5,6,7-Tetrahydro-4-benzothiophenone, 4-Oxo-4,5,6,7-tetrahydrothianaphthene, 6,7-dihydro-5H-1-benzothiophen-4-one, 4-Keto-4,5,6,7-tetrahydrothlanaphthene, 4-Keto-4,5,6,7-tetrahydro-thianaphthene, 4-Oxo-4,5,6,7-tetrahydrobenzo[b]thiophene, 6,7-dihydro-5H-benzothiophen-4-one, MFCD00005861, 6,7-Dihydrobenzo(b)thiophen-4(5H)-one, 4,5,6,7-tetrahydro-1-benzothiophen-4-one, Benzo(b)thiophen-4(5H)-one, 6,7-dihydro-, 4,5,6,7-tetrahydrobenzo(b)thiophen-4-one, 4,5,6,7-tetrahydrobenzo[b]thiophen-4-one, 4-Oxo-4,5,6,7-tetrahydrobenzo(b)thiophene, 4-Keto-4,5,6,7-tetrahydrothianaphthene, 97%, EINECS 236-510-7, NSC 99002, 4,5,6,7-Tetrahydro-4-oxothionaphthene, PubChem13925, AC1Q6JKO, 4,5,6,7-Tetrahydro-4-oxobenzo(b)thiophene, 4,5,6,7-tetrahydro-4-oxo-benzo[b]thiophene, AC1L35EF, AC1Q6EN6, NCIOpen2_002165, BIDD:GT0031, SCHEMBL153954, Jsp002073, DTXSID4065440, CTK3J0267, GJEKNELSXNSYAQ-UHFFFAOYSA-N, ZINC388535, ACN-S003093, ACT05039, CS-M2369, KS-00000C0Y, 4,6,7-Tetrahydrothionaphthen-4-one, ANW-45103, BBL103860, GEO-01077, NSC-99002, SBB038712, STL557670, 4,6,7-Tetrahydro-4-benzothiophenone, 4,6,7-Tetrahydro-4-oxothionaphthene, 4-Oxo-4,6,7-tetrahydrothianaphthene, 4-keto-4,6,7-Tetrahydrothianaphthene, AKOS000267158, AC-3289, CD-1752, MCULE-3656781441, PB11579, RP21641, RTC-061217, TRA0051354, 5,6,7-trihydrobenzo[b]thiophen-4-one, 6,7-dihydro-1-benzthiophen-4(5H)one, 4,5,6, 7-Tetrahydrothionaphthen-4-one, 4,5,6, 7-Tetrahydro-4-oxothionaphthene, 4-Keto-4?5?6?7-tetrahydrothianaphthene, AJ-20674, AK-46453, AN-13106, AS-18677, Benzo[b]thiophen-4(5H)-one,7-dihydro-, BR-46453, CJ-03288, SC-25058, SY004638, ZB011576, 3-Benzyl-5(2-OHEt)-4-mEtthiazolium Cl, 4-keto-4,5,6, 7-Tetrahydrothianaphthene, 6,7-dihydro-1-benzothiophene-4(5H)-one, 6,7-Dihydro-4-benzo[b]thiophenone, 98%, AB1000161, DB-012558, ST2406360, TC-061217, 4-?Oxo-?4,5,6,7-?tetrahydrothianaphthene, BB 0260337, FT-0082007, FT-0617129, X0270, 4-?Keto-?4,5,6,7-?tetrahydrothianaphthene, 6, {7-Dihydrobenzo[b]thiophen-4(5H)-one}, EN300-25382, A-1739, {Benzo[b]thiophen-4(5H)-one,} 6,7-dihydro-, 4-?Oxo-?4,5,6,7-?tetrahydrobenzo[b]thiophene, MFCD00005861 (97+%), 414K954, I09-1783, J-640131, J-800135, Q-102486, 4-Keto-4,5,6,7-tetrahydrothianaphthene; 4-Oxo-4,5,6,7-tetrahydrobenzo[b]thiophene; 4-Oxo-4,5,6,7-tetrahydrothianaphthene, C8H8OS, C8-H8-O-S, CID83418, AR-1F8247, A2845, 6,7-Dihydro-4-benzo[b]thiophenone, 98% - 1G 1g, 135050-44-1,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.03g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	152.211g/mol
Monoisotopic Mass	152.03g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number