6-Methoxy-1-tetralone

CAT: 0063-27116667-25gSize: 25 gDry Ice: NoHazardous: No

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CAT#:0063-27116667-25gSize:25 g

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CAS Number

1078-19-9

Molecular Formula

C11H12O2

Molecular Weight

176.21

Formulation

C11H12O2

Chemical Information

6-Methoxy-alpha-tetralone

6-Methoxy-1-tetralone is a member of tetralins.

CAS Number	1078-19-9
PubChem CID	14112
IUPAC Name	6-methoxy-3,4-dihydro-2H-naphthalen-1-one
Molecular Formula	C11H12O2
Molecular Weight	176.21
XLogP	2
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	200

SMILES

COC1=CC2=C(C=C1)C(=O)CCC2

InChI

InChI=1S/C11H12O2/c1-13-9-5-6-10-8(7-9)3-2-4-11(10)12/h5-7H,2-4H2,1H3

InChIKey

MNALUTYMBUBKNX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1078-19-9

CID: 14112

Formula: C11H12O2

MW: 176.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	176.21
XLogP3	2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	176.083729621
Monoisotopic Mass	176.083729621
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	200
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
HY-34408-01	6-Methoxy-1-tetralone
M09680-01	6-Methoxy-1-tetralone 99%
OR6769	6-Methoxy-1-tetralone oxime
283922-01	6-Methoxy-2-tetralone
OR94717-01	6-Methoxy-2-methyl-1-tetralone
FM25203-01	7-Methoxy-1-tetralone
OR943451-01	6-Methoxy-2-phenyl-tetralone
sc-239051	5-Methoxy-1-tetralone
438737-01	6-Methoxy-1-tetralone discontinued. See 283693
AR-L07082-01	Levonorgestrel Impurity 13 (6-Methoxy-1-tetralone)