1-iodo-4-methoxybenzene

CAT: 1731-FH 10 0029-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:1731-FH 10 0029-01Size:1 mg

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CAS Number

696-62-8

MDL Number

MFCD00001056

Purity

0.95

Smiles

COc1ccc (I) cc1

Shipping Conditions

Room temperature, no cold chain required

Chemical Information

4-Iodoanisole

(alpha-D-mannosyl)7-beta-D-mannosyl-diacetylchitobiosyl-L-asparagine, isoform B (protein) is a member of methoxybenzenes.

CAS Number	696-62-8
PubChem CID	69676
IUPAC Name	1-iodo-4-methoxybenzene
Molecular Formula	C7H7IO
Molecular Weight	234.03
XLogP	2.9
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	77

SMILES

COC1=CC=C(C=C1)I

InChI

InChI=1S/C7H7IO/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3

InChIKey

SYSZENVIJHPFNL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 696-62-8

CID: 69676

Formula: C7H7IO

MW: 234.03

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	234.03
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	233.95416
Monoisotopic Mass	233.95416
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	77
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
GT HW 0457-01	2-chloro-4- (chloromethyl) -1-methoxybenzene
FH 10 0020-01	1-iodo-4-nitrobenzene
FH 1G 0A10-01	1-iodo-4- (4-methylphenyl) sulfanylbenzene
AN EU 2966-01	3-iodo-4-methoxybenzaldehyde
FH 1C 00B3-01	2-iodo-1- (2-iodophenyl) -4-methylbenzene
FH SE 0019-01	1- (2-iodo-4-methylphenyl) -4-methyl-2-nitrobenzene
GT HW 3433-01	1,3-bis (bromomethyl) -2-methoxybenzene
FH HG 0062-01	Methyl 4-iodo-2- (5-iodo-2-methoxycarbonylphenyl) benzoate
FH 1W 0001-01	2-iodo-3- (2-iodophenyl) -1,4-dimethylbenzene
FH 2C 0016-01	1-iodo-2-nitrobenzene

Catalog	Name
DRB26394-01	1-Fluoro-2-iodo-4-methoxybenzene
415687-01	2-Bromo-1-iodo-4-methoxybenzene
OR1080458-01	2-Ethoxy-4-iodo-1-methoxybenzene
OR1087851-01	1-Ethoxy-4-iodo-2-methoxybenzene
OR1084709-01	1-ethoxy-2-iodo-4-methoxybenzene
OR1094454	4-Ethyl-2-iodo-1-methoxybenzene
OR1093720-01	1- (Benzyloxy) -4-iodo-2-methoxybenzene
OR1092064-01	2-ethoxy-1-iodo-4-methoxybenzene
OR1092040-01	4-Iodo-1-isopropoxy-2-methoxybenzene
OR1090944-01	1- (benzyloxy) -2-iodo-4-methoxybenzene