N-Allyl-N-methylaniline

HCID 246778

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Basic information

CAS: 6628-07-5
Standard SMILES: C=CCN(C)c1ccccc1
InChIKey: WJYIMFNLIJXFMX-UHFFFAOYSA-N
Molecular formula: C10H13N
Average molar mass: 147.22 g/mol
Monoisotopic mass: 147.10479942

Names & identifiers

Preferred name: N-Allyl-N-methylaniline
IUPAC: N-methyl-N-prop-2-enylaniline
English name: N-Allyl-N-methylaniline
Molecular formula: C10H13N
Molecular weight: 147.22

Names & synonyms

N-ALLYL-N-METHYLANILINE6628-07-5DTXSID40289317RefChem:828952DTXCID40240463800-704-5n-methyl-n-(prop-2-en-1-yl)anilineN-methyl-N-prop-2-enylanilineN-methyl-N-allylanilineNSC60287allyl-N-methylanilineN-allyl-N-methyl-aniline

Show more names

AllylmethylphenylamineN-Methyl-N-phenylallylamineBenzenamine, N-methyl-N-2-propen-1-yl-

SCHEMBL1257194SCHEMBL3290812SCHEMBL8672253SCHEMBL9279908SCHEMBL9514799NSC-60287AKOS006227949DB-371331

Database identifiers

CAS: 6628-07-5
PubChem CID: 246778
DTXSID: DTXSID40289317
EC Number: 800-704-5
Nikkaji: J184.191B

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 3.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 114

Experimental & physicochemical properties

SpringerMaterials PropertiesViscosity

Physicochemical properties

Boiling point: 214 · 214-216°C
Density: 0.946 · 0.946±0.06 g/cm3(Predicted)
pka: 4.44 · 4.44±0.50(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H335-H319
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Risk Statements: 20 · 20/21/22-36/37/38
Safety Statements: 26 · 26-36/37/39

Safety & regulation

GHS classification

GHS Classification · 4 items

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)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

risk_code: 20/21/22-36/37/38
Signal word: Warning
Symbol(GHS): GHS07
safety_code: 26-36/37/39
Hazard statements: H315-H335-H319
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P