Basic information
- CAS
2017-68-7- Standard SMILES
NCCc1ccc2ccccc2c1- InChIKey
ZOBYXAWBGJRPRG-UHFFFAOYSA-N- Molecular formula
- C12H13N
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.10479942
Overview
structure in first source
Names & identifiers
- Preferred name
- 2-(2-Naphthyl)ethyl-amine
- IUPAC
- 2-naphthalen-2-ylethanamine
- English name
- 2-Naphthalen-2-yl-ethylamine
- Molecular formula
- C12H13N
- Molecular weight
- 171.24
Names & synonyms
2-(2-naphthyl)ethyl-amineRefChem:4615822017-68-72-(naphthalen-2-yl)ethanamine2-Naphthalen-2-yl-ethylamine2-Naphthaleneethanamine2-naphthalen-2-ylethanamine2-(2-NAPHTHYL)ETHANAMINE2-(NAPHTHALEN-2-YL)ETHAN-1-AMINEMFCD015298682-Naphthalen-2-ylethylaminenaphth-2-ylethyl amine
Show more names
RARECHEM AL BW 0248CHEMBRDG-BB 4004145SALOR-INT L300306-1EA2-phthalen-2-yl-ethylamine2-NAPHTHALEN-2-YL-ETHYLAMIN2-(2-naphthalenyl)ethanamine2-(naphthalen-6-yl)ethanamine
2-Naphth-2-ylethylamine2-(2-naphthyl)ethyl amineSCHEMBL38430SCHEMBL132340SCHEMBL6038388SCHEMBL9527298SCHEMBL10721028SCHEMBL29860016
Database identifiers
- CAS
2017-68-7- PubChem CID
- 3784378
- DTXSID
DTXSID60396370
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
Physicochemical properties
- Boiling point
- 160 · 160-165 °C(Press: 15 Torr)
- Density
- 1.069 · 1.069±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- solubility
- Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
- pka
- 9.84 · 9.84±0.10(Predicted)
- form
- Semi-Solid
- color
- Pale Yellow to Light Yellow
- Symbol(GHS)
- 7 · GHS07,GHS09,GHS05
- Signal word
- Danger
- Hazard statements
- 302 · H302-H318-H410
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P273-P391-P501-P280-P305+P351+P338-P310
- HS Code
- 2921490090 · 2921490090
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P354+P338, P317, P330, P391, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2921490090
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS09,GHS05
- Hazard statements
- H302-H318-H410
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P273-P391-P501-P280-P305+P351+P338-P310
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers31 total
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
上海爱孜康医药研究有限公司
Related reactions
18 records
Compound notes
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