N-Benzyl-N-(trimethylsilylmethyl)aminoacetonitrile

HCID 560960

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Basic information

CAS: 87813-07-8
Standard SMILES: C[Si](C)(C)CN(CC#N)Cc1ccccc1
InChIKey: MIAHSUODJNPFGX-UHFFFAOYSA-N
Molecular formula: C13H20N2Si
Average molar mass: 232.4 g/mol

Names & identifiers

Preferred name: N-Benzyl-N-(trimethylsilylmethyl)aminoacetonitrile
IUPAC: 2-[benzyl(trimethylsilylmethyl)amino]acetonitrile
English name: N-benzyl-N-(trimethylsilylmethyl)aminoacetonitrile
Molecular formula: C13H20N2Si
Molecular weight: 232.4

Names & synonyms

87813-07-8RefChem:829206N-BENZYL-N-(TRIMETHYLSILYLMETHYL)AMINOACETONITRILE685-030-8SCHEMBL1232938AKOS024365002(Benzyl[(trimethylsilyl)methyl]amino)acetonitrile #2-(Benzyl((trimethylsilyl)methyl)amino)acetonitrileN-Benzyl-N-(trimethylsilylmethyl)amino-acetonitrile(N-Benzyl-N-trimethylsilanylmethyl-amino)acetonitrileN-benzyl-N-(cyanomethyl)-N-[(trimethylsilyl)methyl]amine[Benzyl(trimethylsilylmethyl)amino]acetonitrile

Show more names

Acetonitrile, 2-[(phenylmethyl)[(trimethylsilyl)methyl]amino]-

Database identifiers

CAS: 87813-07-8
PubChem CID: 560960
EC Number: 685-030-8
Nikkaji: J308.004H

Properties

Computed structural properties

Topological polar surface area: 27 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 5
Heavy atoms: 16
Formal charge: 0
Complexity: 242

Physicochemical properties

Density: 0.942 g/mL · 0.942 g/mL at 25 °C(lit.)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 312 · H312-H315-H319-H332-H335-H302
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P261-P271-P304+P340-P312
Hazard Codes: Xn
Risk Statements: 20 · 20/21/22-36/37/38
Safety Statements: 26 · 26-37/39

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

risk_code: 20/21/22-36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xn
safety_code: 26-37/39
Hazard statements: H312-H315-H319-H332-H335-H302
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P261-P271-P304+P340-P312