3-Iodo-8-methylquinoline

CAT: 0926-ZGC24596-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-ZGC24596-01Size:50 mg

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CAS Number

1424245-96-4

MDL Number

MFCD27500864

Smiles

CC1=C2C (=CC=C1) C=C (C=N2) I

Molecular Formula

C10H8IN

Molecular Weight

269.08 g/mol

Controlled

Chemical Information

3-Iodo-8-methylquinoline

CAS Number	1424245-96-4
PubChem CID	59191861
IUPAC Name	3-iodo-8-methylquinoline
Molecular Formula	C10H8IN
Molecular Weight	269.08
XLogP	3.3
Topological Polar Surface Area	12.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	160

SMILES

CC1=C2C(=CC=C1)C=C(C=N2)I

InChI

InChI=1S/C10H8IN/c1-7-3-2-4-8-5-9(11)6-12-10(7)8/h2-6H,1H3

InChIKey

HXXVZZCLBYBYLR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1424245-96-4

CID: 59191861

Formula: C10H8IN

MW: 269.08

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	269.08
XLogP3	3.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	268.97015
Monoisotopic Mass	268.97015
Topological Polar Surface Area	12.9 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	160
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
XQA32376-01	8-Bromo-3-methylquinoline
PDC43240-01	2,8-Dichloro-3-methylquinoline
XNC98390-01	8-Fluoro-6-methylquinoline-3-carbonitrile
PBA59311-01	4-Chloro-8-methoxy-3-methylquinoline
CEC44319-01	3-Bromo-8-fluoro-6-methylquinoline
JAC51995-01	3-Bromo-8-fluoro-2-methylquinoline
EAA22585	2-Chloro-8-methylquinoline
ASB91073-01	8-Fluoro-6-methylquinoline
NBA46277-01	8-Methylquinoline-2-carbaldehyde
VGC79463-01	8-Fluoro-7-methylquinoline

Catalog	Name
OR92992-01	5-Iodo-8-methylquinoline
OR76992-01	3-Iodo-6-methylquinoline
OR1004640	6-Chloro-8-iodo-2-methylquinoline
OR87960-01	6-Iodo-4- (3-methoxyphenylamino) -8-methylquinoline-3-carboxamide
TRC-I337850-250MG	4-Iodo-2-methylquinoline
OR1039522-01	6-Iodo-4-methylquinoline
OR1075340	2-Iodo-4-methylquinoline
OR1080576	6-Iodo-2-methylquinoline
OR1068947-01	7-Iodo-2-methylquinoline
439936-01	8-Acetoxy-3-methylquinoline