CAS 148900-69-0 (2-Methoxypyridin-4-yl)methanamine (HCID 16227983)

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Basic information

CAS: 148900-69-0
Standard SMILES: COc1cc(CN)ccn1
InChIKey: UQAHBOKPZNLKRF-UHFFFAOYSA-N
Molecular formula: C7H10N2O
Average molar mass: 138.17 g/mol
Monoisotopic mass: 138.07931295

Names & identifiers

Preferred name: (2-Methoxypyridin-4-yl)methanamine
IUPAC: (2-methoxy-4-pyridinyl)methanamine
English name: 4-Pyridinemethanamine,2-methoxy-(9CI)
Molecular formula: C7H10N2O
Molecular weight: 138.17

Names & synonyms

(2-methoxypyridin-4-yl)methanamineRefChem:396025826-895-5148900-69-04-PYRIDINEMETHANAMINE, 2-METHOXY-(2-METHOXY-4-PYRIDYL)METHANAMINE(2-methoxypyridin-4-yl)methylamineMFCD090546794-(Aminomethyl)-2-methoxypyridine4-Pyridinemethanamine,2-methoxy-(9CI)1-(2-METHOXYPYRIDIN-4-YL)METHANAMINE4-AMINOMETHYL-2-METHOXYPYRIDINE

Show more names

(2-Methoxypyridin-4-yl)4-Aminomethyl-2-methoxypy...2-Methoxy-4-PyridineMethanaMine

CHEMBL4066086(2-methoxy-4-pyridinyl)methanamine2-Methoxy-4-pyridinemethylamineC-(2-Methoxy-pyridin-4-yl)-methylamineSCHEMBL4492002-methoxy4-aminomethylpyridineF2147-1549DTXSID40585482

Database identifiers

CAS: 148900-69-0
PubChem CID: 16227983
DTXSID: DTXSID40585482
ChEMBL: CHEMBL4066086
EC Number: 826-895-5

Properties

Computed structural properties

XLogP: 0
Topological polar surface area: 48.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 10
Formal charge: 0
Complexity: 97

Physicochemical properties

Boiling point: 240.6 · 240.6±25.0 °C(Predicted)
Density: 1.09 · 1.090±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)
pka: 7.41 · 7.41±0.29(Predicted)
Appearance: Colorless to light yellow Liquid
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280-P305+P351+P338-P310
Hazard Codes: T
Risk Statements: 25 · 25
Safety Statements: 45 · 45
RIDADR: 2735 · UN2735
HS Code: 2933399990 · 2933399990

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]；H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (50%)；Acute Tox. 4 (50%)；Acute Tox. 4 (50%)；Skin Irrit. 2 (50%)；Eye Dam. 1 (50%)；Acute Tox. 4 (50%)；STOT SE 3 (50%)