1,2-Diphenylethyl-N-methylamine

HCID 110986

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Basic information

CAS: 53663-25-5
Standard SMILES: CNC(Cc1ccccc1)c1ccccc1
InChIKey: GNMNPHPUCWQGJK-UHFFFAOYSA-N
Molecular formula: C15H17N
Average molar mass: 211.3 g/mol
Monoisotopic mass: 211.13609955

Names & identifiers

Preferred name: 1,2-Diphenylethyl-N-methylamine
IUPAC: N-methyl-1,2-diphenylethanamine
English name: 1,2-Diphenylethyl-N-methylamine
Molecular formula: C15H17N
Molecular weight: 211.3

Names & synonyms

1,2-DIPHENYLETHYL-N-METHYLAMINERefChem:411820637-308-5N-methyl-1,2-diphenylethanamine53663-25-5N-methyl-1,2-diphenylethylamineN-Methyl-1,2-diphenylethan-1-amine(1,2-Diphenylethyl)(Methyl)Amine1,2-diphenyl-ethyl-methyl-amineSCHEMBL1541692SCHEMBL2096552SCHEMBL8634299

Show more names

Benzeneethanamine, N-methyl-α-phenyl-

SCHEMBL27629283DTXSID30276099GNMNPHPUCWQGJK-UHFFFAOYSA-NNSC163179AKOS000171036AKOS016050668NSC-163179

Database identifiers

CAS: 53663-25-5
PubChem CID: 110986
DTXSID: DTXSID30276099
EC Number: 637-308-5

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 12 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 4
Heavy atoms: 16
Formal charge: 0
Complexity: 178

Physicochemical properties

Boiling point: 160 · 160-161 °C(Press: 8 Torr)
Density: 1.01 · 1.010±0.06 g/cm3(Predicted)
pka: 9.36 · 9.36±0.20(Predicted)
Symbol(GHS): 7 · GHS07,GHS05
Signal word: Danger
Hazard statements: 302 · H302-H335-H315-H318
Precautionary statements: 280 · P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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+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 39 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. 4 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

Safety data

Signal word: Danger
Symbol(GHS): GHS07,GHS05
Hazard statements: H302-H335-H315-H318
Precautionary statements: P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362