Basic information
- CAS
782-18-3- Standard SMILES
Nc1ccc(-c2cc3ccccc3o2)cc1- InChIKey
HJLGQPREWJFXII-UHFFFAOYSA-N- Molecular formula
- C14H11NO
- Average molar mass
- 209.24 g/mol
- Monoisotopic mass
- 209.08406397
Names & identifiers
- Preferred name
- 4-(1-Benzofuran-2-yl)aniline
- IUPAC
- 4-(1-benzofuran-2-yl)aniline
- English name
- 4-(1-BENZOFURAN-2-YL)ANILINE
- Molecular formula
- C14H11NO
- Molecular weight
- 209.24
Names & synonyms
4-(1-benzofuran-2-yl)aniline782-18-3DTXSID60352173RefChem:286653DTXCID90303239856-824-34-(Benzofuran-2-yl)anilineMFCD010785844-benzo[d]furan-2-ylphenylamineTimTec1_000904Oprea1_660093SCHEMBL791728
Show more names
4-(2-benzofuranyl)-benzenamineBenzenamine, 4-(2-benzofuranyl)
HMS1536J02AAA78218BBL002162SBB005681STK803102AKOS000216159NCGC00174998-01NCGC00174998-02
Database identifiers
- CAS
782-18-3- PubChem CID
- 720692
- DTXSID
DTXSID60352173- EC Number
- 856-824-3
- Nikkaji
- J3.305.503J
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Melting point
- 123 · 123-124 °C(Solv: acetone (67-64-1))
- Boiling point
- 371.8 · 371.8±17.0 °C(Predicted)
- Density
- 1.203 · 1.203±0.06 g/cm3(Predicted)
- pka
- 3.99 · 3.99±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H319-H335-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
上海钰康生物科技有限公司18939844854 · [email protected]
陕西纯晶萃光电科技有限公司+86-13152027579 13152027579 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
卓萃新材料科技（上海）有限公司021-52836897 13917661608 · [email protected]
Shaanxi pure crystal photoelectric technology co. LTD13817761490 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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