CAS 100-94-7 | Benzenemethanaminium, N,N-dimethyl-N-(phenylmethyl)-, chloride (1:1) | CAS Number 100-94-7

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100-94-7 | Benzenemethanaminium, N,N-dimethyl-N-(phenylmethyl)-, chloride (1:1)

CAS No: 100-94-7 Catalog No: AG00007Q MDL No:MFCD00031706

Product Description

Catalog Number:

AG00007Q

Chemical Name:

Benzenemethanaminium, N,N-dimethyl-N-(phenylmethyl)-, chloride (1:1)

CAS Number:

100-94-7

Molecular Formula:

C16H20ClN

Molecular Weight:

261.7897

MDL Number:

MFCD00031706

IUPAC Name:

dibenzyl(dimethyl)azanium;chloride

InChI:

InChI=1S/C16H20N.ClH/c1-17(2,13-15-9-5-3-6-10-15)14-16-11-7-4-8-12-16;/h3-12H,13-14H2,1-2H3;1H/q+1;/p-1

InChI Key:

LCXAARCEIWRIMU-UHFFFAOYSA-M

SMILES:

C[N+](Cc1ccccc1)(Cc1ccccc1)C.[Cl-]

EC Number:

202-903-7

NSC Number:

Properties

Complexity:

188

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

261.128g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

261.793g/mol

Monoisotopic Mass:

261.128g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
A linear Fe-O-Fe unit in bis(dibenzyldimethylammonium) mu-oxo-bis[tribromoferrate(III)].	Acta crystallographica. Section C, Crystal structure communications 20061001
A triptycene-based bis(crown ether) host: complexation with both paraquat derivatives and dibenzylammonium salts.	Organic letters 20060316