Azidobenzene

HCID 69319
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
622-37-7
Standard SMILES
[N-]=[N+]=Nc1ccccc1
InChIKey
CTRLRINCMYICJO-UHFFFAOYSA-N
Molecular formula
C6H5N3
Average molar mass
119.12 g/mol
Monoisotopic mass
119.04834716

Overview

photosensitive hydrophobic non-polar probe; photolabeling agent

Names & identifiers

Preferred name
Azidobenzene
IUPAC
azidobenzene
English name
Phenyl azide
Molecular formula
C6H5N3
Molecular weight
119.12

Names & synonyms

AzidobenzenePhenyl azidePhenylazide622-37-7Benzene, triazo-2G0EH7N6YBNSC-512574DTXSID30878870RefChem:861714DTXCID30910986210-730-3Benzene, azido-
Show more names
triazobenzenephenylazoimidediazobenzeneimidePhenyl azide solutionAzidobenzene solutionAzidomethane solution - 0.5M solution intert-butyl methyl ether
azido-benzenePHENYL AZIDE [MI]CHEMBL3236174SCHEMBL13475909SCHEMBL13584014SCHEMBL14856540SCHEMBL19747825CTRLRINCMYICJO-UHFFFAOYSA-

Database identifiers

CAS
622-37-7
PubChem CID
69319
DTXSID
DTXSID30878870
ChEMBL
CHEMBL3236174
UNII
2G0EH7N6YB
EC Number
210-730-3
Nikkaji
J101.063H

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
14.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
9

Experimental & physicochemical properties

SpringerMaterials Properties15N nuclear magnetic resonance spectrum
LogP2.59

Physicochemical properties

Melting point
-27.5 °C · -27.5°C
Boiling point
212.39 °C · 212.39°C (rough estimate)
Density
1.086 · 1.0860
vapor density
73.5 at · 73.5 at 22-24 mm
refractive index
1.5589 · 1.5589
Flash point
-12 °C · -12°C

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H241 (97.5%): Heating may cause a fire or explosion [Danger Self-reactive substances and mixtures; Organic peroxides]

P210, P234, P235, P240, P260, P264, P264+P265, P270, P280, P302+P352, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P380+P375[+P378], P403, P410, P411, P420, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSelf-react. B (97.5%)

Safety data

wgk
3
ridadr
UN 2398 3 / PGII
risk_code
11-19-48/20/21/22-38
Signal word
Danger
Symbol(GHS)
GHS02,GHS05,GHS07,GHS08
hazard_code
F,Xn

Chemistry & industry

Applications

UsesPhenylazide in greener solvent, 2-methyltetrahydrofuran (2-MeTHF).2-Methyltetrahydrofuran (2-MeTHF): A Biomass-Derived Solvent with Broad Application in Organic Chemistry

General DescriptionAzidobenzene solution can undergo click reaction with alkyne-functionalized oligomers to form O-ester-functionalized o-phenylenes, a group of aromatic foldamers with a good folding tendency in most solvents.

Upstream & downstream products

Suppliers33 total

陕西格列弗生物科技研究有限责任公司13892423764 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海颖心实验室设备有限公司021-59178156 17002132182 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]

Related reactions

50 records
New reaction record

Compound notes

Loading…