AG00C05C

340825-13-0 | 6-Iodo-1-tetralone

AG00C05C

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CAS Number	340825-13-0
Catalog Number	AG00C05C(AGN-PC-07CSXS)
Chemical Name	6-Iodo-1-tetralone
IUPAC Name	6-iodo-3,4-dihydro-2H-naphthalen-1-one
InChI	InChI=1S/C10H9IO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6H,1-3H2
InChI Key	TUMAMZXVZVEYLU-UHFFFAOYSA-N
MDL Number	MFCD09751536
Molecular Formula	C10H9IO
Molecular Weight	272.0823
SMILES	O=C1CCCC2=C1C=CC(I)=C2
Synonyms	340825-13-0, 6-iodo-3,4-dihydronaphthalen-1(2H)-one, 6-iodo-1-tetralone, 6-iodo-3,4-dihydro-2H-naphthalen-1-one, 6-iodo-1,2,3,4-tetrahydronaphthalen-1-one, AK-65229, 1(2H)-Naphthalenone,3,4-dihydro-6-iodo-, 6-Iodo-alpha-Tetralone, 6-iodotetralin-1-one, PubChem17906, 1(2H)-Naphthalenone, 3,4-dihydro-6-iodo-, SCHEMBL315147, CTK4H1707, DTXSID60670465, TUMAMZXVZVEYLU-UHFFFAOYSA-N, KS-00000FG3, 3557AJ, CI-137, MFCD09751536, ZINC49588542, AKOS015915107, AN-1205, FCH1324179, OR41156, QC-1615, RL03259, SB12487, VZ30781, ACM340825130, DA-18119, DS-15743, 6-Iodo-3,4-dihydro-2H-naphthalen-l-one, AB0048626, AJ-111350, AX8109377, 4CH-005592, 6-iodanyl-3,4-dihydro-2H-naphthalen-1-one, CS-0020163, FT-0652367, ST24045412, W-4232, A822067, I14-7285, J-518804, C10H9IO, 231278-84-5,

Complexity	190
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	271.97g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	272.085g/mol
Monoisotopic Mass	271.97g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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