Basic information
- CAS
104163-34-0- Standard SMILES
Cc1ccc(CN)s1- InChIKey
XCBYYXLOEBELSB-UHFFFAOYSA-N- Molecular formula
- C6H9NS
- Average molar mass
- 127.21 g/mol
- Monoisotopic mass
- 127.04557029
Names & identifiers
- Preferred name
- (5-Methylthiophen-2-yl)methanamine
- IUPAC
- (5-methylthiophen-2-yl)methanamine
- English name
- 5-methyl-2-Thiophenemethanamine
- Molecular formula
- C6H9NS
- Molecular weight
- 127.21
Names & synonyms
(5-methylthiophen-2-yl)methanamine104163-34-0DTXSID50401841RefChem:404144DTXCID40352696817-460-05-METHYLTHIOPHEN-2-YLMETHYLAMINE5-METHYL-2-THIOPHENEMETHANAMINE1-(5-methyl-2-thienyl)methanamine2-(Aminomethyl)-5-methylthiopheneMFCD00965306C-(5-METHYL-THIOPHEN-2-YL)-METHYLAMINE
Show more names
5-methylthiophene-2-ylmethylamine[(5-Methyl-2-thienyl)methyl]amine hydrochloride1-(5-methyl-2-thienyl)methanamine(SALTDATA: FREE)
(5-METHYLTHIEN-2-YL)METHYLAMINE1-(5-methyl-2-thienyl)methanamine hydrochloride2-Thiophenemethanamine, 5-methyl-2-Thiophenemethanamine,5-methyl-1-(5-METHYLTHIOPHEN-2-YL)METHANAMINE(5-Methylthiophen-2-yl)SCHEMBL128771(5-methyl-2-thienyl)methanamine
Database identifiers
- CAS
104163-34-0- PubChem CID
- 4313442
- DTXSID
DTXSID50401841- EC Number
- 817-460-0
- Nikkaji
- J675.608E
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 74.9
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Boiling point
- 68 · 68-69 °C(Press: 4 Torr)
- Density
- 1.104 · 1.104±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 8.98 · 8.98±0.29(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 301 · P301+P310
- Risk Statements
- 34 · 34
- Safety Statements
- 26 · 26-27-36/37/39-45
- RIDADR
- 3267 · 3267
- HazardClass
- IRRITANT
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, 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. 3 (100%)
Safety data
- ridadr
- 3267
- hs_code
- 29349990
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- safety_code
- 26-27-36/37/39-45
- hazard_class
- IRRITANT
- Hazard statements
- H301
- Precautionary statements
- P301+P310
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers41 total
上海康恩博医药科技有限公司17510465506 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
上海睿升化工科技有限公司+86-021-50935922
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
上海太氟医药科技有限公司021-58111238 18930958102
阳谷荣科商贸有限公司15863541132 · [email protected]
Related reactions
9 records
Compound notes
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