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1-Iodo-2-(methoxymethoxy)benzene

HCID 11747465
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
80778-47-8
Standard SMILES
COCOc1ccccc1I
InChIKey
KGARCSYHUWHUMQ-UHFFFAOYSA-N
Molecular formula
C8H9IO2
Average molar mass
264.06 g/mol
Monoisotopic mass
263.96472753

Names & identifiers

Preferred name
1-Iodo-2-(methoxymethoxy)benzene
IUPAC
1-iodo-2-(methoxymethoxy)benzene
English name
1-iodo-2-(methoxymethoxy)benzene
Molecular formula
C8H9IO2
Molecular weight
264.06

Names & synonyms

1-iodo-2-(methoxymethoxy)benzene80778-47-8DTXSID30471825RefChem:231031DTXCID40422641Benzene, 1-iodo-2-(methoxymethoxy)-MFCD170137622-methoxymethyloxyiodobenzeneSCHEMBL22924581-iodo-2-methoxymethoxy-benzeneSCHEMBL294031932-Methoxymethyloxy-1-iodobenzene
Show more names
1-Iodo-2-(methoxymethoxy)benzene - [K88153]
KGARCSYHUWHUMQ-UHFFFAOYSA-NAKOS009391735DA-02649SY345221CS-0363836E91331F754609A1-05121

Database identifiers

CAS
80778-47-8
PubChem CID
11747465
DTXSID
DTXSID30471825
Nikkaji
J465.009C

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
11
Formal charge
0
Complexity
108

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers7 total

安徽合诺生物科技有限公司0555-2761852
安徽合诺生物科技有限公司18455579438
南京代盟化工有限公司02566880956 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
清远均成高新材料有限公司18316607267
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

5 records
New reaction record
HRID 97635 reaction equation
HRID 97635As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1220587 reaction equation
HRID 1220587As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1280720 reaction equation
HRID 1280720As reactantuspto-grants-2002_09
HRID 1359281 reaction equation
HRID 1359281As productuspto-grants-2003_07
HRID 1359320 reaction equation
HRID 1359320As reactantuspto-grants-2003_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes