AG00952Q

1204-23-5 | 2(1H)​-​Naphthalenone, 3,​4-​dihydro-​7-​methoxy-​1-​methyl-

AG00952Q

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CAS Number	1204-23-5
Catalog Number	AG00952Q(AGN-PC-0NAQHX)
Chemical Name	2(1H)​-​Naphthalenone, 3,​4-​dihydro-​7-​methoxy-​1-​methyl-
IUPAC Name	7-methoxy-1-methyl-3,4-dihydro-1H-naphthalen-2-one
InChI	InChI=1S/C12H14O2/c1-8-11-7-10(14-2)5-3-9(11)4-6-12(8)13/h3,5,7-8H,4,6H2,1-2H3
InChI Key	DYIWPPSNJSVFED-UHFFFAOYSA-N
MDL Number	MFCD00797848
Molecular Formula	C12H14O2
Molecular Weight	190.2384
SMILES	CC1c2c(ccc(c2)OC)CCC1=O
Synonyms	7-Methoxy-1-methyl-2-tetralone, 1204-23-5, 7-methoxy-1-methyl-3,4-dihydronaphthalen-2(1H)-one, 3,4-dihydro-7-methoxy-1-methyl-2(1H)-naphthalenone, 7-methoxy-1-methyl-3,4-dihydro-1H-naphthalen-2-one, SCHEMBL5512979, 1-methyl-7-methoxy-2-tetralone, DYIWPPSNJSVFED-UHFFFAOYSA-N, 1-methyl- 7-methoxy-2-tetralone, 7-methoxy-1-methyl-tetralin-2-one, 6489AJ, AKOS006271706, ACN-048950, CS-W000443, AS-32497, SY018567, TC-308029, Z-4458, 7-methoxy-1-methyl-3,4-dihydro-2(1H)-naphthalenone, 7-methoxy-1-methyl-1,2,3,4-tetrahydronaphthalen-2-one, 1-Methyl-7-methoxy-1,2,3,4-tetrahydronaphthalene-2-one, C12H14O2, CID10797755, 759-05-7,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.099g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	190.242g/mol
Monoisotopic Mass	190.099g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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