CAS 17610-21-8 | Ethanone, 1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)- | CAS Number 17610-21-8

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17610-21-8 | Ethanone, 1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-

CAS No: 17610-21-8 Catalog No: AG0021FD MDL No:MFCD00052727

Product Description

Catalog Number:

AG0021FD

Chemical Name:

Ethanone, 1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-

CAS Number:

17610-21-8

Molecular Formula:

C16H22O

Molecular Weight:

230.3453

MDL Number:

MFCD00052727

IUPAC Name:

1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethanone

InChI:

InChI=1S/C16H22O/c1-11(17)12-6-7-13-14(10-12)16(4,5)9-8-15(13,2)3/h6-7,10H,8-9H2,1-5H3

InChI Key:

IHUSZOMIBSDQTB-UHFFFAOYSA-N

SMILES:

CC(=O)c1ccc2c(c1)C(C)(C)CCC2(C)C

Properties

Complexity:

314

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.167g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.351g/mol

Monoisotopic Mass:

230.167g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.7

Literature

Title	Journal
Discovery of tetrahydrotetramethylnaphthalene analogs as adult T-cell leukemia cell-selective proliferation inhibitors in a small chemical library constructed based on multi-template hypothesis.	Bioorganic & medicinal chemistry 20090701
Disila-okoumal: a silicon analogue of the ambergris odorant okoumal.	Chembiochem : a European journal of chemical biology 20070813