7-Methoxyquinoline

CAT: 0926-FM42221-02Size: 1000 mgDry Ice: NoHazardous: No

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CAT#:0926-FM42221-02Size:1000 mg

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CAS Number

4964-76-5

MDL Number

MFCD00870291

Smiles

COC1=CC2=C (C=CC=N2) C=C1

Molecular Formula

C10H9NO

Molecular Weight

159.18 g/mol

Controlled

Chemical Information

7-Methoxyquinoline

structure given in first source

CAS Number	4964-76-5
PubChem CID	78666
IUPAC Name	7-methoxyquinoline
Molecular Formula	C10H9NO
Molecular Weight	159.18
XLogP	2.4
Topological Polar Surface Area	22.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	149

SMILES

COC1=CC2=C(C=CC=N2)C=C1

InChI

InChI=1S/C10H9NO/c1-12-9-5-4-8-3-2-6-11-10(8)7-9/h2-7H,1H3

InChIKey

IVHJSNNMKJWPFW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4964-76-5

CID: 78666

Formula: C10H9NO

MW: 159.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	159.18
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	159.068413911
Monoisotopic Mass	159.068413911
Topological Polar Surface Area	22.1 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	149
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
LBA74898-01	7-Chloro-8-methoxyquinoline
MKB76991	7-fluoro-6-methoxyquinoline
DFC86076-01	7-Bromo-5-methoxyquinoline
DEA02833-01	7-Bromo-6-methoxyquinoline
BJB97312-01	3,7-Difluoro-6-methoxyquinoline
ABA75994	4-chloro-7-fluoro-6-methoxyquinoline
CYA96768-01	2-Chloro-7-fluoro-6-methoxyquinoline
TXB38855-01	2-Chloro-6-methoxyquinoline-7-sulfonyl chloride
FM25354-01	6-Methoxyquinoline
FM42335-01	5-Methoxyquinoline

Catalog	Name
TRC-M267405-5G	7-Methoxyquinoline
T206018-01	7-Methoxyquinoline Hydrochloride
sc-232770	4-Hydroxy-7-methoxyquinoline
OR1034705-01	7-Bromo-4-methoxyquinoline
OR82270-01	7-Bromo-8-methoxyquinoline
OR302274	7-Methoxyquinoline-4-carbonitrile
OR307954-01	4-Amino-7-methoxyquinoline
440030-01	8-Bromo-7-methoxyquinoline
sc-290053A	4-Bromo-7-methoxyquinoline
OR1075363	4-Iodo-7-methoxyquinoline