2-iodo-7-methoxynaphthalene

CAT: 0127-OR1082037Size: 1 EachDry Ice: NoHazardous: No

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CAS Number

128542-48-3

MDL Number

MFCD18412655

Smiles

C1 (ccc2c (c1) cc (cc2) OC) I

Chemical Information

2-Iodo-7-methoxynaphthalene

CAS Number	128542-48-3
PubChem CID	14876030
IUPAC Name	2-iodo-7-methoxynaphthalene
Molecular Formula	C11H9IO
Molecular Weight	284.09
XLogP	3.8
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	171

SMILES

COC1=CC2=C(C=C1)C=CC(=C2)I

InChI

InChI=1S/C11H9IO/c1-13-11-5-3-8-2-4-10(12)6-9(8)7-11/h2-7H,1H3

InChIKey

ZCTZDZKAMWOSHC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 128542-48-3

CID: 14876030

Formula: C11H9IO

MW: 284.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	284.09
XLogP3	3.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	283.96981
Monoisotopic Mass	283.96981
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	171
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
OR1084244-01	2-Iodo-1-methoxynaphthalene
OR1098564-01	2-Iodo-3-methoxynaphthalene
OR1001302	1-Iodo-2-methoxynaphthalene
OR1098440	2-iodo-6-methoxynaphthalene
OR1099512	1-iodo-4-methoxynaphthalene
OR470815-01	2-Bromo-7-methoxynaphthalene
OR470813	2- (Bromomethyl) -7-methoxynaphthalene
BUP19206	2-Methoxynaphthalene
OR925439-01	2-Methoxynaphthalene
OR83644-01	1-Bromo-7-methoxynaphthalene

Catalog	Name
QDA38143-01	7-Methoxynaphthalene-2-carbonitrile
FAA66523-01	7-Methoxynaphthalene-2-carbaldehyde
TRC-M264685-50G	2-Methoxynaphthalene
HY-W010179R-01	2-Methoxynaphthalene (Standard)
HY-W010179S	2-Methoxynaphthalene-d7
414680-01	2-[2,6-Bis (2-methoxyethenyl) phenyl]-7-methoxynaphthalene
HY-W010179S1	2-Methoxynaphthalene-d2
BA4014-100	7-Iodo-7-deaza-2-deoxyguanosine
MBS5799698	7-Iodo-7-deaza-2'-deoxyguanosine
FB00553-01	2-Bromo-6-methoxynaphthalene