Completing data — usually done within a minute
Basic information
- CAS
103790-50-7- Standard SMILES
Cc1cc(OCCO)ccc1N- InChIKey
NWASPLRNFPQETR-UHFFFAOYSA-N- Molecular formula
- C9H13NO2
- Average molar mass
- 167.2 g/mol
- Monoisotopic mass
- 167.09462866
Names & identifiers
- Preferred name
- 2-(4-Amino-3-methylphenoxy)ethan-1-ol
- IUPAC
- 2-(4-amino-3-methylphenoxy)ethanol
Names & synonyms
2-(4-amino-3-methylphenoxy)ethan-1-ol103790-50-7RefChem:456672863-033-72-(4-amino-3-methylphenoxy)ethanolMFCD086964642-(4-amino-3-methyl-phenoxy)ethanolSCHEMBL5453470NWASPLRNFPQETR-UHFFFAOYSA-NDEA790504-(2-hydroxyethoxy)-2-methylanilineAKOS000245481
Show more names
DB-121614CS-0250990EN300-53108G54869A1-13199Z335092234
Database identifiers
- CAS
103790-50-7- PubChem CID
- 459259
- EC Number
- 863-033-7
Properties
Computed structural propertiesFilling in
- XLogP
- 0.5
- Topological polar surface area
- 55.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 130
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)
Related reactions
2 records
Compound notes
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