Basic information
- CAS
10021-67-7- Standard SMILES
NCC(O)c1cccs1- InChIKey
LOULKRKJFMPTJQ-UHFFFAOYSA-N- Molecular formula
- C6H9NOS
- Average molar mass
- 143.21 g/mol
- Monoisotopic mass
- 143.04048491
Names & identifiers
- Preferred name
- 2-Amino-1-(thiophen-2-yl)ethan-1-ol
- IUPAC
- 2-amino-1-thiophen-2-ylethanol
- English name
- 2-Amino-1-thiophen-2-yl-ethanol
- Molecular formula
- C6H9NOS
- Molecular weight
- 143.21
Names & synonyms
2-amino-1-(thiophen-2-yl)ethan-1-ol62019-66-3RefChem:463245870-864-910021-67-72-amino-1-thiophen-2-ylethanol2-amino-1-thiophen-2-yl-ethanol2-amino-1-(2-thienyl)ethanolMFCD040384022-Thiophenemethanol, a-(aminomethyl)-F2189-0701SCHEMBL4131049
Show more names
AKOS BC-12742-Thiophenemethanol, α-(aminomethyl)-, (αS)-
DTXSID10331175LOULKRKJFMPTJQ-UHFFFAOYSA-NSMSSF-0533755MCA019662-amino-1-(2-thienyl)-1-ethanolAKOS000123375AKOS016051339alpha-(aminomethyl)-2-thiophenmethanol
Database identifiers
- CAS
10021-67-7、62019-66-3- PubChem CID
- 436152
- DTXSID
DTXSID10331175- EC Number
- 673-952-3、870-864-9
- Nikkaji
- J532.112C
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 89.1
Physicochemical properties
- Melting point
- 82 · 82-83°C
- Boiling point
- 298.7 · 298.7±25.0 °C(Predicted)
- Density
- 1.259 · 1.259±0.06 g/cm3(Predicted)
- pka
- 11.56 · 11.56±0.35(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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.
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Hazard information
Hazard Classes and Categories
Skin Irrit. 2 (100%)
Acute Tox. 4 (100%)
Safety data
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Hazard statements
- H319-H315-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers1 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Related reactions
1 records
Compound notes
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