(4-Aminophenoxy)benzene

HCID 8764CAS 139-59-3

Basic information

Standard SMILES
Nc1ccc(Oc2ccccc2)cc1
InChIKey
WOYZXEVUWXQVNV-UHFFFAOYSA-N
Molecular formula
C12H11NO
Average molar mass
185.22 g/mol
Monoisotopic mass
185.08406397

Names & identifiers

Preferred name
(4-Aminophenoxy)benzene
IUPAC
4-phenoxyaniline
English name
4-Phenoxyaniline
Molecular formula
C12H11NO
Molecular weight
185.22

Names & synonyms

4-PHENOXYANILINE139-59-34-Aminodiphenyl etherp-PhenoxyanilineBenzenamine, 4-phenoxy-Aniline, p-phenoxy-44P7PAW368NSC-4629DTXSID8059687(4-aminophenoxy)benzeneRefChem:518227DTXCID6034506
Show more names
3-Methyl-5-sulfanilamidoisothiazoleBidizoleAmidozoleNSC 139593AKOS B019893AKOS AUF020074-Phenoxanilinep-phenoxy-anilin
205-367-24-Phenoxybenzenamine4-Aminophenyl phenyl ether4-Amino-1-phenoxybenzene4-Aminodifenylether4-Aminobiphenyl ether4-Aminodiphenyletherp-Aminophenyl phenyl ether

Database identifiers

CAS
139-59-3
PubChem CID
8764
DTXSID
DTXSID8059687
ChEMBL
CHEMBL249550
UNII
44P7PAW368
EC Number
205-367-2
Nikkaji
J33.852D

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
35.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14

Physicochemical properties

Melting point
82 · 82-84 °C(lit.)
Boiling point
140 °C · 140 °C (2.2503 mmHg)
Density
1.0936 · 1.0936 (rough estimate)
refractive index
1.53 · 1.5300 (estimate)
storage temp.
RT, protect from light
form
Crystalline Flakes or Powder

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (89.6%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (97.9%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (89.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H341 (14.6%): Suspected of causing genetic defects [Warning Germ cell mutagenicity];H400 (12.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (12.5%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P203, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%);Skin Irrit. 2 (89.6%);Skin Sens. 1 (97.9%);Eye Irrit. 2 (100%);STOT SE 3 (89.6%);Muta. 2 (14.6%);Aquatic Acute 1 (12.5%);Aquatic Chronic 1 (12.5%)

Safety data

F
9
PPE
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
wgk
3
tsca
TSCA listed
rtecs
BY7930000
hs_code
29222990

Chemistry & industry

Pharmacology

Metabolism/Metabolites4-phenoxyaniline has known human metabolites that include N-(4-Phenoxyphenyl)acetamide.

Uses & manufacturing

General Manufacturing InformationBenzenamine, 4-phenoxy-: ACTIVE

Applications

Uses4-Phenoxyaniline is used as a dye intermediate.

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
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]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海凌凯科技股份有限公司58950110 13124863828 · [email protected]

Related reactions

228 records

Linked notes

Loading…