1-Iodonaphthalene (HCID 7004)

Names & identifiers

Preferred name: 1-Iodonaphthalene
IUPAC: 1-iodonaphthalene
English name: 1-Iodonaphthalene
Molecular formula: C10H7I
Molecular weight: 254.07

Names & synonyms

1-IODONAPHTHALENENaphthalene, 1-iodo-IodonaphthaleneEINECS 201-968-9NSC 9275DTXSID30590041Naphthyl iodidealphaIodonaphthaleneNaphthalene, 1iodoRefChem:76100DTXCID0048686201-968-9

Show more names

1-IodonaphthaLa-Jodnnphthalin1-Naphtyl iodide1-Iodonapthalene1-iodo-naphthalen1-lodonaphthalene

InChI=1/C10H7I/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7NHPPIJMARIVBGU-UHFFFAOYSA-N90-14-21-Naphthyl iodide1-Iodonaphthalenenalpha-Iodonaphthalene1-Iodo-naphthaleneMFCD00003876

Database identifiers

CAS: 90-14-2
PubChem CID: 7004
DTXSID: DTXSID3059004
UNII: T9FTE2K5Q5
EC Number: 201-968-9
Nikkaji: J43.524D

Properties

Computed structural properties

XLogP: 4.2
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 0
Heavy atoms: 11
Formal charge: 0
Complexity: 133

Experimental & physicochemical properties

Chemical ClassesOther Classes -> Naphthalenes

SpringerMaterials Properties13C nuclear magnetic resonance spectrum

Vapor Pressure0.000894 [mmHg]

Physical DescriptionLiquid; [Alfa Aesar MSDS]

Physicochemical properties

Melting point: 4 °C · 4°C
Boiling point: 163 · 163-165 °C/15 mmHg (lit.)
Density: 1.74 g/mL · 1.74 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.701(lit.)
Flash point: 230 °F · >230 °F
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
solubility: 0.007 g/l · 0.007g/l
form: liquid (clear)
color: clear very deep brown-yellow
Specific Gravity: 1.74 · 1.74
Water Solubility: Slightly soluble in water.
Sensitive: Light Sensitive
BRN: 1906415 · 1906415
Dielectric constant: 4.56 · 4.5599999999999996
InChI: 1S/C10H7I/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
InChIKey: NHPPIJMARIVBGU-UHFFFAOYSA-N
SMILES: Ic1cccc2ccccc12
CAS DataBase Reference: 90 · 90-14-2(CAS DataBase Reference)
NIST Chemistry Reference: 1 · 1-Iodonaphthalene(90-14-2)
EPA Substance Registry System: 1 · Naphthalene, 1-iodo- (90-14-2)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313
PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36-37/39
WGK Germany: 3 · 3
F: 8 · 8
TSCA: TSCA listed
HS Code: 29036990 · 29036990
Storage Class: 10 · 10 - Combustible liquids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazards SummaryA skin and strong eye irritant; [Alfa Aesar MSDS]

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

F: 8
PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
tsca: TSCA listed
hs_code: 29036990
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36-37/39
Storage Class: 10 - Combustible liquids
Hazard statements: H315-H319
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2
Precautionary statements: P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313

Chemistry & industry

Uses & manufacturing

UsesUsed in organic syntheses; [REPROTOX]

General Manufacturing InformationNaphthalene, 1-iodo-: ACTIVE

Applications · 2 items

Uses1-Iodonaphthalene undergoes Pd catalyzed cross-coupling reaction (Stille reaction) with 2,4-dimethoxy-6-(trimethylstannyl)pyrimidine to afford 2,4-dimethoxy-6-(naphthalen-1-yl)pyrimidine.

General DescriptionUltrafast relaxation of 1-iodonaphthalene has been studied by time-resolved femtosecond pump-probe mass spectrometry. 1-Iodonaphthalene undergoes Pd catalyzed cross-coupling reaction (Stille reaction) with 2,4-dimethoxy-6-(trimethylstannyl)pyrimidine to afford 2,4-dimethoxy-6-(naphthalen-1-yl)pyrimidine.

Upstream & downstream products

Upstream raw materials

Downstream products

1-Naphthalenemethanol 7H-Benz[de]anthracen-7-one, 11-nitro-1-(4-Bromophenyl)-naphthlene 4,4'-Dinitrodiphenic acid 2-(1-Naphthylene)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 1,1'-Binaphthyl

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

合肥翰刚医药科技有限公司+8618062405514 · [email protected]

武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]

温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

Related reactions

55 records

New reaction record

HRID 142820As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 192414As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 256854As reactantuspto-grants-1993_11

HRID 278471As reactantuspto-grants-2002_03

HRID 368911As reactantuspto-grants-2000_10

HRID 386381As reactantuspto-grants-2013_02

HRID 440950As reactantuspto-grants-1996_05

HRID 441820As reactantuspto-grants-1977_08

Linked notes

Loading…

Basic information